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Y5Z
Y5Z
Name:N-{4-[4-(2-amino-4-oxo-3,4-dihydro-5H-pyrrolo[3,2-d]pyrimidin-5-yl)butyl]-2-fluorobenzoyl}-L-gamma-glutamyl-L-glutamic acid
Formula:C27 H31 F N6 O9
SMILES:O=C(O)C(CCC(=O)O)NC(=O)CCC(NC(=O)c1ccc(cc1F)CCCCn1ccc2N=C(N)NC(=O)c21)C(=O)O
InChi:InChI=1S/C27H31FN6O9/c28-16-13-14(3-1-2-11-34-12-10-17-22(34)24(39)33-27(29)32-17)4-5-15(16)23(38)31-19(26(42)43)6-8-20(35)30-18(25(40)41)7-9-21(36)37/h4-5,10,12-13,18-19H,1-3,6-9,11H2,(H,30,35)(H,31,38)(H,36,37)(H,40,41)(H,42,43)(H3,29,32,33,39)/t18-,19-/m0/s1
Definition date:2023-06-12
Last modified:2024-02-16
Release date:2024-02-21
Identifier:N-{4-[4-(2-amino-4-oxo-3,4-dihydro-5H-pyrrolo[3,2-d]pyrimidin-5-yl)butyl]-2-fluorobenzoyl}-L-gamma-glutamyl-L-glutamic acid
YNW
YNW
Name:(6M)-2-(benzylamino)-6-(2-chloro-4-methylphenyl)-1H-benzimidazole-4-carboxylic acid
Formula:C22 H18 Cl N3 O2
SMILES:O=C(O)c1cc(cc2[NH]c(nc12)NCc1ccccc1)c1ccc(C)cc1Cl
InChi:InChI=1S/C22H18ClN3O2/c1-13-7-8-16(18(23)9-13)15-10-17(21(27)28)20-19(11-15)25-22(26-20)24-12-14-5-3-2-4-6-14/h2-11H,12H2,1H3,(H,27,28)(H2,24,25,26)
Definition date:2023-02-13
Last modified:2024-02-16
Release date:2024-02-21
Identifier:(6M)-2-(benzylamino)-6-(2-chloro-4-methylphenyl)-1H-benzimidazole-4-carboxylic acid
YO6
YO6
Name:[2-(4-fluoroanilino)-1,3-thiazol-4-yl]acetic acid
Formula:C11 H9 F N2 O2 S
SMILES:O=C(O)Cc1csc(Nc2ccc(F)cc2)n1
InChi:InChI=1S/C11H9FN2O2S/c12-7-1-3-8(4-2-7)13-11-14-9(6-17-11)5-10(15)16/h1-4,6H,5H2,(H,13,14)(H,15,16)
Definition date:2023-02-13
Last modified:2024-02-16
Release date:2024-02-21
Identifier:[2-(4-fluoroanilino)-1,3-thiazol-4-yl]acetic acid
YOB
YOB
Name:(8S)-2-({[2-chloro-5-(pyridin-4-yl)phenyl]methyl}amino)-5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Formula:C20 H19 Cl N6 O
SMILES:Clc1ccc(cc1CNc1nc2NC(=CC(=O)n2n1)CCC)c1ccncc1
InChi:InChI=1S/C20H19ClN6O/c1-2-3-16-11-18(28)27-20(24-16)25-19(26-27)23-12-15-10-14(4-5-17(15)21)13-6-8-22-9-7-13/h4-11H,2-3,12H2,1H3,(H2,23,24,25,26)
Definition date:2023-02-13
Last modified:2024-02-16
Release date:2024-02-21
Identifier:(8S)-2-({[2-chloro-5-(pyridin-4-yl)phenyl]methyl}amino)-5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
U69
U69
Name:2-cyclopentylideneethyl dihydrogen phosphate
Formula:C7 H13 O4 P
SMILES:O=P(O)(O)OCC=C1CCCC1
InChi:InChI=1S/C7H13O4P/c8-12(9,10)11-6-5-7-3-1-2-4-7/h5H,1-4,6H2,(H2,8,9,10)
Definition date:2023-08-30
Last modified:2024-02-16
Release date:2024-02-21
Identifier:2-cyclopentylideneethyl dihydrogen phosphate
ULC
ULC
Name:~{O}-(5,6,7,8-tetrahydronaphthalen-2-yl) ~{N}-(6-methoxypyridin-2-yl)-~{N}-methyl-carbamothioate
Formula:C18 H20 N2 O2 S
SMILES:COc1cccc(n1)N(C)C(=S)Oc2ccc3CCCCc3c2
InChi:InChI=1S/C18H20N2O2S/c1-20(16-8-5-9-17(19-16)21-2)18(23)22-15-11-10-13-6-3-4-7-14(13)12-15/h5,8-12H,3-4,6-7H2,1-2H3
Definition date:2023-02-07
Last modified:2024-02-16
Release date:2024-02-21
Identifier:~{O}-(5,6,7,8-tetrahydronaphthalen-2-yl) ~{N}-(6-methoxypyridin-2-yl)-~{N}-methyl-carbamothioate
YP3
YP3
Name:5-bromo-2-hydroxy-N-[(quinolin-6-yl)methyl]benzamide
Formula:C17 H13 Br N2 O2
SMILES:Brc1cc(c(O)cc1)C(=O)NCc1ccc2ncccc2c1
InChi:InChI=1S/C17H13BrN2O2/c18-13-4-6-16(21)14(9-13)17(22)20-10-11-3-5-15-12(8-11)2-1-7-19-15/h1-9,21H,10H2,(H,20,22)
Definition date:2023-02-15
Last modified:2024-02-16
Release date:2024-02-21
Identifier:5-bromo-2-hydroxy-N-[(quinolin-6-yl)methyl]benzamide
YP8
YP8
Name:(8S)-5-benzyl-2-({[(5P)-2-chloro-5-(1-methyl-1H-pyrazol-3-yl)phenyl]methyl}amino)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Formula:C23 H20 Cl N7 O
SMILES:Cn1ccc(n1)c1cc(CNc2nc3NC(=CC(=O)n3n2)Cc2ccccc2)c(Cl)cc1
InChi:InChI=1S/C23H20ClN7O/c1-30-10-9-20(28-30)16-7-8-19(24)17(12-16)14-25-22-27-23-26-18(13-21(32)31(23)29-22)11-15-5-3-2-4-6-15/h2-10,12-13H,11,14H2,1H3,(H2,25,26,27,29)
Definition date:2023-02-15
Last modified:2024-02-16
Release date:2024-02-21
Identifier:(8S)-5-benzyl-2-({[(5P)-2-chloro-5-(1-methyl-1H-pyrazol-3-yl)phenyl]methyl}amino)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
ULR
ULR
Name:4-[(3~{S})-3-ethylpiperazin-1-yl]-2-fluoranyl-~{N}-(2-methylimidazo[1,2-a]pyrazin-6-yl)benzamide
Formula:C20 H23 F N6 O
SMILES:CC[CH]1CN(CCN1)c2ccc(c(F)c2)C(=O)Nc3cn4cc(C)nc4cn3
InChi:InChI=1S/C20H23FN6O/c1-3-14-11-26(7-6-22-14)15-4-5-16(17(21)8-15)20(28)25-18-12-27-10-13(2)24-19(27)9-23-18/h4-5,8-10,12,14,22H,3,6-7,11H2,1-2H3,(H,25,28)/t14-/m0/s1
Synonyms:SMN-CY
Definition date:2023-02-07
Last modified:2024-02-16
Release date:2024-02-21
Identifier:4-[(3~{S})-3-ethylpiperazin-1-yl]-2-fluoranyl-~{N}-(2-methylimidazo[1,2-a]pyrazin-6-yl)benzamide
YPD
YPD
Name:(2Z)-N-[4-(4-chlorobenzene-1-sulfonyl)phenyl]-2-cyano-3-hydroxy-3-(5-methyl-1,2-oxazol-4-yl)prop-2-enamide
Formula:C20 H14 Cl N3 O5 S
SMILES:Cc1oncc1C(/O)=C(C#N)C(=O)Nc1ccc(cc1)S(=O)(=O)c1ccc(Cl)cc1
InChi:InChI=1S/C20H14ClN3O5S/c1-12-18(11-23-29-12)19(25)17(10-22)20(26)24-14-4-8-16(9-5-14)30(27,28)15-6-2-13(21)3-7-15/h2-9,11,25H,1H3,(H,24,26)/b19-17-
Definition date:2023-02-15
Last modified:2024-02-16
Release date:2024-02-21
Identifier:(2Z)-N-[4-(4-chlorobenzene-1-sulfonyl)phenyl]-2-cyano-3-hydroxy-3-(5-methyl-1,2-oxazol-4-yl)prop-2-enamide
UZX
UZX
Name:2-[[3,5-bis(chloranyl)phenyl]carbamoylamino]benzamide
Formula:C14 H11 Cl2 N3 O2
SMILES:NC(=O)c1ccccc1NC(=O)Nc2cc(Cl)cc(Cl)c2
InChi:InChI=1S/C14H11Cl2N3O2/c15-8-5-9(16)7-10(6-8)18-14(21)19-12-4-2-1-3-11(12)13(17)20/h1-7H,(H2,17,20)(H2,18,19,21)
Definition date:2023-02-17
Last modified:2024-02-16
Release date:2024-02-21
Identifier:2-[[3,5-bis(chloranyl)phenyl]carbamoylamino]benzamide
YPL
YPL
Name:5-bromo-2-hydroxy-N-{[(3M)-3-(1-methyl-1H-pyrazol-4-yl)phenyl]methyl}benzamide
Formula:C18 H16 Br N3 O2
SMILES:Cn1cc(cn1)c1cc(CNC(=O)c2cc(Br)ccc2O)ccc1
InChi:InChI=1S/C18H16BrN3O2/c1-22-11-14(10-21-22)13-4-2-3-12(7-13)9-20-18(24)16-8-15(19)5-6-17(16)23/h2-8,10-11,23H,9H2,1H3,(H,20,24)
Definition date:2023-02-15
Last modified:2024-02-16
Release date:2024-02-21
Identifier:5-bromo-2-hydroxy-N-{[(3M)-3-(1-methyl-1H-pyrazol-4-yl)phenyl]methyl}benzamide
YPU
YPU
Name:5-bromo-N-{[(5P)-2-fluoro-5-(1-methyl-1H-pyrazol-4-yl)phenyl]methyl}-2-hydroxybenzamide
Formula:C18 H15 Br F N3 O2
SMILES:Cn1cc(cn1)c1cc(CNC(=O)c2cc(Br)ccc2O)c(F)cc1
InChi:InChI=1S/C18H15BrFN3O2/c1-23-10-13(9-22-23)11-2-4-16(20)12(6-11)8-21-18(25)15-7-14(19)3-5-17(15)24/h2-7,9-10,24H,8H2,1H3,(H,21,25)
Definition date:2023-02-15
Last modified:2024-02-16
Release date:2024-02-21
Identifier:5-bromo-N-{[(5P)-2-fluoro-5-(1-methyl-1H-pyrazol-4-yl)phenyl]methyl}-2-hydroxybenzamide
YQ3
YQ3
Name:(5M)-5-(2-chloro-4-methylphenyl)-1-[(pyridin-4-yl)methyl]-1H-benzimidazole-7-carboxylic acid
Formula:C21 H16 Cl N3 O2
SMILES:Cc1ccc(c2cc3ncn(Cc4ccncc4)c3c(c2)C(=O)O)c(Cl)c1
InChi:InChI=1S/C21H16ClN3O2/c1-13-2-3-16(18(22)8-13)15-9-17(21(26)27)20-19(10-15)24-12-25(20)11-14-4-6-23-7-5-14/h2-10,12H,11H2,1H3,(H,26,27)
Definition date:2023-02-15
Last modified:2024-02-16
Release date:2024-02-21
Identifier:(5M)-5-(2-chloro-4-methylphenyl)-1-[(pyridin-4-yl)methyl]-1H-benzimidazole-7-carboxylic acid
V0F
V0F
Name:(4~{S})-4-methyl-16,18-bis(oxidanyl)-3-azabicyclo[12.4.0]octadeca-1(18),12,14,16-tetraene-2,8-dione
Formula:C18 H23 N O4
SMILES:C[CH]1CCCC(=O)CCCC=Cc2cc(O)cc(O)c2C(=O)N1
InChi:InChI=1S/C18H23NO4/c1-12-6-5-9-14(20)8-4-2-3-7-13-10-15(21)11-16(22)17(13)18(23)19-12/h3,7,10-12,21-22H,2,4-6,8-9H2,1H3,(H,19,23)/b7-3+/t12-/m0/s1
Definition date:2023-02-20
Last modified:2024-02-16
Release date:2024-02-21
Identifier:(4~{S})-4-methyl-16,18-bis(oxidanyl)-3-azabicyclo[12.4.0]octadeca-1(18),12,14,16-tetraene-2,8-dione
YQ8
YQ8
Name:4-(4-chlorophenyl)-7,8-dimethoxy-5-methyl-4H-pyrido[2,3,4-de]quinazoline
Formula:C19 H16 Cl N3 O2
SMILES:Clc1ccc(cc1)N1C(C)=Cc2c(OC)c(cc3ncnc1c32)OC
InChi:InChI=1S/C19H16ClN3O2/c1-11-8-14-17-15(9-16(24-2)18(14)25-3)21-10-22-19(17)23(11)13-6-4-12(20)5-7-13/h4-10H,1-3H3
Definition date:2023-02-15
Last modified:2024-02-16
Release date:2024-02-21
Identifier:4-(4-chlorophenyl)-7,8-dimethoxy-5-methyl-4H-pyrido[2,3,4-de]quinazoline
YQC
YQC
Name:(8S)-2-({[(5P)-2-chloro-5-(1-methyl-1H-pyrazol-3-yl)phenyl]methyl}amino)-5-(2-phenylethyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Formula:C24 H22 Cl N7 O
SMILES:Cn1ccc(n1)c1cc(CNc2nc3NC(=CC(=O)n3n2)CCc2ccccc2)c(Cl)cc1
InChi:InChI=1S/C24H22ClN7O/c1-31-12-11-21(29-31)17-8-10-20(25)18(13-17)15-26-23-28-24-27-19(14-22(33)32(24)30-23)9-7-16-5-3-2-4-6-16/h2-6,8,10-14H,7,9,15H2,1H3,(H2,26,27,28,30)
Definition date:2023-02-15
Last modified:2024-02-16
Release date:2024-02-21
Identifier:(8S)-2-({[(5P)-2-chloro-5-(1-methyl-1H-pyrazol-3-yl)phenyl]methyl}amino)-5-(2-phenylethyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
YQH
YQH
Name:(2Z)-N-(4-acetylphenyl)-2-cyano-3-hydroxy-3-(5-methyl-1,2-oxazol-4-yl)prop-2-enamide
Formula:C16 H13 N3 O4
SMILES:Cc1oncc1C(/O)=C(C#N)C(=O)Nc1ccc(cc1)C(C)=O
InChi:InChI=1S/C16H13N3O4/c1-9(20)11-3-5-12(6-4-11)19-16(22)13(7-17)15(21)14-8-18-23-10(14)2/h3-6,8,21H,1-2H3,(H,19,22)/b15-13-
Definition date:2023-02-15
Last modified:2024-02-16
Release date:2024-02-21
Identifier:(2Z)-N-(4-acetylphenyl)-2-cyano-3-hydroxy-3-(5-methyl-1,2-oxazol-4-yl)prop-2-enamide
U7M
U7M
Name:1-butyl-3-(4-sulfamoylphenyl)urea
Formula:C11 H17 N3 O3 S
SMILES:CCCCNC(=O)Nc1ccc(cc1)[S](N)(=O)=O
InChi:InChI=1S/C11H17N3O3S/c1-2-3-8-13-11(15)14-9-4-6-10(7-5-9)18(12,16)17/h4-7H,2-3,8H2,1H3,(H2,12,16,17)(H2,13,14,15)
Synonyms:4-(3-butylureido)benzenesulfonamide
Definition date:2023-01-27
Last modified:2024-02-16
Release date:2024-02-21
Identifier:1-butyl-3-(4-sulfamoylphenyl)urea
YQL
YQL
Name:(6M)-6-(2-chloro-4-methylphenyl)-2-[(morpholin-4-yl)methyl]-1H-benzimidazole-4-carboxylic acid
Formula:C20 H20 Cl N3 O3
SMILES:O=C(O)c1cc(cc2[NH]c(CN3CCOCC3)nc12)c1ccc(C)cc1Cl
InChi:InChI=1S/C20H20ClN3O3/c1-12-2-3-14(16(21)8-12)13-9-15(20(25)26)19-17(10-13)22-18(23-19)11-24-4-6-27-7-5-24/h2-3,8-10H,4-7,11H2,1H3,(H,22,23)(H,25,26)
Definition date:2023-02-15
Last modified:2024-02-16
Release date:2024-02-21
Identifier:(6M)-6-(2-chloro-4-methylphenyl)-2-[(morpholin-4-yl)methyl]-1H-benzimidazole-4-carboxylic acid
YQQ
YQQ
Name:(2-{3-[(5-bromo-2-hydroxybenzamido)methyl]anilino}-1,3-thiazol-4-yl)acetic acid
Formula:C19 H16 Br N3 O4 S
SMILES:Brc1cc(c(O)cc1)C(=O)NCc1cc(ccc1)Nc1nc(cs1)CC(=O)O
InChi:InChI=1S/C19H16BrN3O4S/c20-12-4-5-16(24)15(7-12)18(27)21-9-11-2-1-3-13(6-11)22-19-23-14(10-28-19)8-17(25)26/h1-7,10,24H,8-9H2,(H,21,27)(H,22,23)(H,25,26)
Definition date:2023-02-15
Last modified:2024-02-16
Release date:2024-02-21
Identifier:(2-{3-[(5-bromo-2-hydroxybenzamido)methyl]anilino}-1,3-thiazol-4-yl)acetic acid
YQU
YQU
Name:(5M)-5-(2-chloro-4-methylphenyl)-1-(2-phenylethyl)-1H-benzimidazole-7-carboxylic acid
Formula:C23 H19 Cl N2 O2
SMILES:Cc1ccc(c2cc3ncn(CCc4ccccc4)c3c(c2)C(=O)O)c(Cl)c1
InChi:InChI=1S/C23H19ClN2O2/c1-15-7-8-18(20(24)11-15)17-12-19(23(27)28)22-21(13-17)25-14-26(22)10-9-16-5-3-2-4-6-16/h2-8,11-14H,9-10H2,1H3,(H,27,28)
Definition date:2023-02-15
Last modified:2024-02-16
Release date:2024-02-21
Identifier:(5M)-5-(2-chloro-4-methylphenyl)-1-(2-phenylethyl)-1H-benzimidazole-7-carboxylic acid
WC9
WC9
Name:(4S,5aS,8S,8aR)-4-(2-methylpropyl)-N-[(1R,5Z,7R,8R,9R,10R,11S,12R)-10,11,12-trihydroxy-7-methyl-13-oxa-2-thiabicyclo[7.3.1]tridec-5-en-8-yl]octahydro-2H-oxepino[2,3-c]pyrrole-8-carboxamide (non-preferred name)
Formula:C25 H42 N2 O6 S
SMILES:CC(C)CC1CC2CNC(C2OCC1)C(=O)NC1C2OC(SCCC=CC1C)C(O)C(O)C2O
InChi:InChI=1S/C25H42N2O6S/c1-13(2)10-15-7-8-32-22-16(11-15)12-26-18(22)24(31)27-17-14(3)6-4-5-9-34-25-21(30)19(28)20(29)23(17)33-25/h4,6,13-23,25-26,28-30H,5,7-12H2,1-3H3,(H,27,31)/b6-4-/t14-,15+,16+,17-,18+,19+,20-,21-,22-,23-,25-/m1/s1
Definition date:2023-09-29
Last modified:2024-02-16
Release date:2024-02-21
Identifier:(4S,5aS,8S,8aR)-4-(2-methylpropyl)-N-[(1R,5Z,7R,8R,9R,10R,11S,12R)-10,11,12-trihydroxy-7-methyl-13-oxa-2-thiabicyclo[7.3.1]tridec-5-en-8-yl]octahydro-2H-oxepino[2,3-c]pyrrole-8-carboxamide (non-preferred name)
YQZ
YQZ
Name:(8R)-2-{[([1,1'-biphenyl]-4-yl)methyl]amino}-5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Formula:C21 H21 N5 O
SMILES:O=C1C=C(Nc2nc(nn12)NCc1ccc(cc1)c1ccccc1)CCC
InChi:InChI=1S/C21H21N5O/c1-2-6-18-13-19(27)26-21(23-18)24-20(25-26)22-14-15-9-11-17(12-10-15)16-7-4-3-5-8-16/h3-5,7-13H,2,6,14H2,1H3,(H2,22,23,24,25)
Definition date:2023-02-15
Last modified:2024-02-16
Release date:2024-02-21
Identifier:(8R)-2-{[([1,1'-biphenyl]-4-yl)methyl]amino}-5-propyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
YR6
YR6
Name:(2Z)-2-cyano-N-[(4P)-4-(3-fluorophenyl)-5-(methanesulfonyl)pyrimidin-2-yl]-3-hydroxy-3-(5-methyl-1,2-oxazol-4-yl)prop-2-enamide
Formula:C19 H14 F N5 O5 S
SMILES:Cc1oncc1C(/O)=C(C#N)C(=O)Nc1nc(c2cccc(F)c2)c(cn1)S(C)(=O)=O
InChi:InChI=1S/C19H14FN5O5S/c1-10-14(8-23-30-10)17(26)13(7-21)18(27)25-19-22-9-15(31(2,28)29)16(24-19)11-4-3-5-12(20)6-11/h3-6,8-9,26H,1-2H3,(H,22,24,25,27)/b17-13-
Definition date:2023-02-15
Last modified:2024-02-16
Release date:2024-02-21
Identifier:(2Z)-2-cyano-N-[(4P)-4-(3-fluorophenyl)-5-(methanesulfonyl)pyrimidin-2-yl]-3-hydroxy-3-(5-methyl-1,2-oxazol-4-yl)prop-2-enamide

223532

건을2024-08-07부터공개중

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