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LV9

LV9
Name:	N-(4-benzyloxan-4-yl)-N'-(pyridin-3-yl)urea
Formula:	C18 H21 N3 O2
SMILES:	O=C(NC1(CCOCC1)Cc1ccccc1)Nc1cccnc1
InChi:	InChI=1S/C18H21N3O2/c22-17(20-16-7-4-10-19-14-16)21-18(8-11-23-12-9-18)13-15-5-2-1-3-6-15/h1-7,10,14H,8-9,11-13H2,(H2,20,21,22)
Definition date:	2023-08-15
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	N-(4-benzyloxan-4-yl)-N'-(pyridin-3-yl)urea

QEX

QEX
Name:	N-(isoquinolin-4-yl)-2-(3-methylphenyl)acetamide
Formula:	C18 H16 N2 O
SMILES:	Cc1cccc(c1)CC(=O)Nc1cncc2ccccc21
InChi:	InChI=1S/C18H16N2O/c1-13-5-4-6-14(9-13)10-18(21)20-17-12-19-11-15-7-2-3-8-16(15)17/h2-9,11-12H,10H2,1H3,(H,20,21)
Definition date:	2023-08-18
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	N-(isoquinolin-4-yl)-2-(3-methylphenyl)acetamide

P7R

P7R
Name:	(4R)-6-chloro-N-(1-methyl-2-oxo-2,3-dihydro-1H-imidazo[4,5-c]pyridin-7-yl)-3,4-dihydro-2H-1-benzopyran-4-carboxamide
Formula:	C17 H15 Cl N4 O3
SMILES:	CN1c2c(NC1=O)cncc2NC(=O)C1CCOc2ccc(Cl)cc21
InChi:	InChI=1S/C17H15ClN4O3/c1-22-15-12(7-19-8-13(15)21-17(22)24)20-16(23)10-4-5-25-14-3-2-9(18)6-11(10)14/h2-3,6-8,10H,4-5H2,1H3,(H,20,23)(H,21,24)/t10-/m1/s1
Definition date:	2023-08-18
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	(4R)-6-chloro-N-(1-methyl-2-oxo-2,3-dihydro-1H-imidazo[4,5-c]pyridin-7-yl)-3,4-dihydro-2H-1-benzopyran-4-carboxamide

KP0

KP0
Name:	N-(3-chlorophenyl)-N-(2-cyclohexylethyl)-N'-(pyridin-3-yl)urea
Formula:	C20 H24 Cl N3 O
SMILES:	O=C(Nc1cccnc1)N(CCC1CCCCC1)c1cccc(Cl)c1
InChi:	InChI=1S/C20H24ClN3O/c21-17-8-4-10-19(14-17)24(13-11-16-6-2-1-3-7-16)20(25)23-18-9-5-12-22-15-18/h4-5,8-10,12,14-16H,1-3,6-7,11,13H2,(H,23,25)
Definition date:	2023-08-14
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	N-(3-chlorophenyl)-N-(2-cyclohexylethyl)-N'-(pyridin-3-yl)urea

R76

R76
Name:	(4S)-6-chloro-N-(isoquinolin-4-yl)-2-[2-(methylamino)-2-oxoethyl]-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Formula:	C22 H19 Cl N4 O3
SMILES:	CNC(=O)CN1CC(c2cc(Cl)ccc2C1=O)C(=O)Nc1cncc2ccccc21
InChi:	InChI=1S/C22H19ClN4O3/c1-24-20(28)12-27-11-18(17-8-14(23)6-7-16(17)22(27)30)21(29)26-19-10-25-9-13-4-2-3-5-15(13)19/h2-10,18H,11-12H2,1H3,(H,24,28)(H,26,29)/t18-/m1/s1
Definition date:	2023-08-21
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	(4S)-6-chloro-N-(isoquinolin-4-yl)-2-[2-(methylamino)-2-oxoethyl]-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide

QF5

QF5
Name:	N-(isoquinolin-4-yl)-2-phenylacetamide
Formula:	C17 H14 N2 O
SMILES:	O=C(Cc1ccccc1)Nc1cncc2ccccc21
InChi:	InChI=1S/C17H14N2O/c20-17(10-13-6-2-1-3-7-13)19-16-12-18-11-14-8-4-5-9-15(14)16/h1-9,11-12H,10H2,(H,19,20)
Definition date:	2023-08-18
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	N-(isoquinolin-4-yl)-2-phenylacetamide

NIJ

NIJ
Name:	3-(3-fluorophenyl)-N-(4-methylpyridin-3-yl)propanamide
Formula:	C15 H15 F N2 O
SMILES:	O=C(Nc1cnccc1C)CCc1cccc(F)c1
InChi:	InChI=1S/C15H15FN2O/c1-11-7-8-17-10-14(11)18-15(19)6-5-12-3-2-4-13(16)9-12/h2-4,7-10H,5-6H2,1H3,(H,18,19)
Definition date:	2023-08-16
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	3-(3-fluorophenyl)-N-(4-methylpyridin-3-yl)propanamide

LVM

LVM
Name:	N-(4-methylpyridin-3-yl)-2-(spiro[2.3]hexan-5-yl)acetamide
Formula:	C14 H18 N2 O
SMILES:	O=C(Nc1cnccc1C)CC1CC2(CC2)C1
InChi:	InChI=1S/C14H18N2O/c1-10-2-5-15-9-12(10)16-13(17)6-11-7-14(8-11)3-4-14/h2,5,9,11H,3-4,6-8H2,1H3,(H,16,17)
Definition date:	2023-08-15
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	N-(4-methylpyridin-3-yl)-2-(spiro[2.3]hexan-5-yl)acetamide

QF6

QF6
Name:	8-methoxyquinolin-4-amine
Formula:	C10 H10 N2 O
SMILES:	COc1cccc2c(N)ccnc12
InChi:	InChI=1S/C10H10N2O/c1-13-9-4-2-3-7-8(11)5-6-12-10(7)9/h2-6H,1H3,(H2,11,12)
Definition date:	2022-06-07
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	8-methoxyquinolin-4-amine

R7F

R7F
Name:	(4R)-6-chloro-N-[6-(2-hydroxypropan-2-yl)isoquinolin-4-yl]-1,2,3,4-tetrahydroquinoline-4-carboxamide
Formula:	C22 H22 Cl N3 O2
SMILES:	CC(C)(O)c1cc2c(cc1)cncc2NC(=O)C1CCNc2ccc(Cl)cc21
InChi:	InChI=1S/C22H22ClN3O2/c1-22(2,28)14-4-3-13-11-24-12-20(17(13)9-14)26-21(27)16-7-8-25-19-6-5-15(23)10-18(16)19/h3-6,9-12,16,25,28H,7-8H2,1-2H3,(H,26,27)/t16-/m1/s1
Definition date:	2023-08-21
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	(4R)-6-chloro-N-[6-(2-hydroxypropan-2-yl)isoquinolin-4-yl]-1,2,3,4-tetrahydroquinoline-4-carboxamide

QF9

QF9
Name:	2-(3-chloro-5-cyanophenyl)-N-(isoquinolin-4-yl)acetamide
Formula:	C18 H12 Cl N3 O
SMILES:	N#Cc1cc(cc(Cl)c1)CC(=O)Nc1cncc2ccccc21
InChi:	InChI=1S/C18H12ClN3O/c19-15-6-12(5-13(7-15)9-20)8-18(23)22-17-11-21-10-14-3-1-2-4-16(14)17/h1-7,10-11H,8H2,(H,22,23)
Definition date:	2023-08-18
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	2-(3-chloro-5-cyanophenyl)-N-(isoquinolin-4-yl)acetamide

L3I

L3I
Name:	2-(3-chlorophenyl)-2-methyl-N-(4-methylpyridin-3-yl)propanamide
Formula:	C16 H17 Cl N2 O
SMILES:	O=C(Nc1cnccc1C)C(C)(C)c1cccc(Cl)c1
InChi:	InChI=1S/C16H17ClN2O/c1-11-7-8-18-10-14(11)19-15(20)16(2,3)12-5-4-6-13(17)9-12/h4-10H,1-3H3,(H,19,20)
Definition date:	2023-08-15
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	2-(3-chlorophenyl)-2-methyl-N-(4-methylpyridin-3-yl)propanamide

QFL

QFL
Name:	2-(4-fluorophenyl)-N-(isoquinolin-4-yl)acetamide
Formula:	C17 H13 F N2 O
SMILES:	Fc1ccc(cc1)CC(=O)Nc1cncc2ccccc21
InChi:	InChI=1S/C17H13FN2O/c18-14-7-5-12(6-8-14)9-17(21)20-16-11-19-10-13-3-1-2-4-15(13)16/h1-8,10-11H,9H2,(H,20,21)
Definition date:	2023-08-18
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	2-(4-fluorophenyl)-N-(isoquinolin-4-yl)acetamide

L3R

L3R
Name:	(2~{S},3~{R},4~{R},5~{S},6~{R})-2-[3-[[5-(4-fluorophenyl)thiophen-2-yl]methyl]-4-methyl-phenyl]-6-(hydroxymethyl)oxane-3,4,5-triol
Formula:	C24 H25 F O5 S
SMILES:	Cc1ccc(cc1Cc2sc(cc2)c3ccc(F)cc3)[CH]4O[CH](CO)[CH](O)[CH](O)[CH]4O
InChi:	InChI=1S/C24H25FO5S/c1-13-2-3-15(24-23(29)22(28)21(27)19(12-26)30-24)10-16(13)11-18-8-9-20(31-18)14-4-6-17(25)7-5-14/h2-10,19,21-24,26-29H,11-12H2,1H3/t19-,21-,22+,23-,24+/m1/s1
Synonyms:	Canagliflozin
Definition date:	2022-11-09
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	(2~{S},3~{R},4~{R},5~{S},6~{R})-2-[3-[[5-(4-fluorophenyl)thiophen-2-yl]methyl]-4-methyl-phenyl]-6-(hydroxymethyl)oxane-3,4,5-triol

QFU

QFU
Name:	2-(3-cyanophenyl)-N-(isoquinolin-4-yl)acetamide
Formula:	C18 H13 N3 O
SMILES:	N#Cc1cccc(c1)CC(=O)Nc1cncc2ccccc21
InChi:	InChI=1S/C18H13N3O/c19-10-14-5-3-4-13(8-14)9-18(22)21-17-12-20-11-15-6-1-2-7-16(15)17/h1-8,11-12H,9H2,(H,21,22)
Definition date:	2023-08-18
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	2-(3-cyanophenyl)-N-(isoquinolin-4-yl)acetamide

KQ3

KQ3
Name:	N-(3-chlorophenyl)-N-[2-(morpholin-4-yl)ethyl]-N'-(pyridin-3-yl)urea
Formula:	C18 H21 Cl N4 O2
SMILES:	Clc1cccc(c1)N(CCN1CCOCC1)C(=O)Nc1cccnc1
InChi:	InChI=1S/C18H21ClN4O2/c19-15-3-1-5-17(13-15)23(8-7-22-9-11-25-12-10-22)18(24)21-16-4-2-6-20-14-16/h1-6,13-14H,7-12H2,(H,21,24)
Definition date:	2023-08-14
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	N-(3-chlorophenyl)-N-[2-(morpholin-4-yl)ethyl]-N'-(pyridin-3-yl)urea

R87

R87
Name:	(4S)-6-chloro-N-(7-fluoroisoquinolin-4-yl)-4-methoxy-3,4-dihydro-2H-1-benzopyran-4-carboxamide
Formula:	C20 H16 Cl F N2 O3
SMILES:	Fc1ccc2c(c1)cncc2NC(=O)C1(CCOc2ccc(Cl)cc21)OC
InChi:	InChI=1S/C20H16ClFN2O3/c1-26-20(6-7-27-18-5-2-13(21)9-16(18)20)19(25)24-17-11-23-10-12-8-14(22)3-4-15(12)17/h2-5,8-11H,6-7H2,1H3,(H,24,25)/t20-/m0/s1
Definition date:	2023-08-22
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	(4S)-6-chloro-N-(7-fluoroisoquinolin-4-yl)-4-methoxy-3,4-dihydro-2H-1-benzopyran-4-carboxamide

NJE

NJE
Name:	N-(4-methylpyridin-3-yl)-2-(piperidin-1-yl)acetamide
Formula:	C13 H19 N3 O
SMILES:	O=C(CN1CCCCC1)Nc1cnccc1C
InChi:	InChI=1S/C13H19N3O/c1-11-5-6-14-9-12(11)15-13(17)10-16-7-3-2-4-8-16/h5-6,9H,2-4,7-8,10H2,1H3,(H,15,17)
Definition date:	2023-08-16
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	N-(4-methylpyridin-3-yl)-2-(piperidin-1-yl)acetamide

NYR

NYR
Name:	N-(3-chlorophenyl)-2-(3-methyl-1H-pyrazol-4-yl)acetamide
Formula:	C12 H12 Cl N3 O
SMILES:	O=C(Cc1c[NH]nc1C)Nc1cccc(Cl)c1
InChi:	InChI=1S/C12H12ClN3O/c1-8-9(7-14-16-8)5-12(17)15-11-4-2-3-10(13)6-11/h2-4,6-7H,5H2,1H3,(H,14,16)(H,15,17)
Definition date:	2023-08-16
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	N-(3-chlorophenyl)-2-(3-methyl-1H-pyrazol-4-yl)acetamide

QG3

QG3
Name:	2-(3,5-difluorophenyl)-N-(isoquinolin-4-yl)acetamide
Formula:	C17 H12 F2 N2 O
SMILES:	Fc1cc(cc(F)c1)CC(=O)Nc1cncc2ccccc21
InChi:	InChI=1S/C17H12F2N2O/c18-13-5-11(6-14(19)8-13)7-17(22)21-16-10-20-9-12-3-1-2-4-15(12)16/h1-6,8-10H,7H2,(H,21,22)
Definition date:	2023-08-18
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	2-(3,5-difluorophenyl)-N-(isoquinolin-4-yl)acetamide

KQL

KQL
Name:	N-(4-methylpyridin-3-yl)-2-[3-(trifluoromethyl)phenyl]acetamide
Formula:	C15 H13 F3 N2 O
SMILES:	O=C(Nc1cnccc1C)Cc1cccc(c1)C(F)(F)F
InChi:	InChI=1S/C15H13F3N2O/c1-10-5-6-19-9-13(10)20-14(21)8-11-3-2-4-12(7-11)15(16,17)18/h2-7,9H,8H2,1H3,(H,20,21)
Definition date:	2023-08-14
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	N-(4-methylpyridin-3-yl)-2-[3-(trifluoromethyl)phenyl]acetamide

LWO

LWO
Name:	2-(1H-benzotriazol-1-yl)-N-[4-(methylamino)phenyl]-N-[(thiophen-3-yl)methyl]acetamide
Formula:	C20 H19 N5 O S
SMILES:	O=C(Cn1nnc2ccccc21)N(Cc1ccsc1)c1ccc(NC)cc1
InChi:	InChI=1S/C20H19N5OS/c1-21-16-6-8-17(9-7-16)24(12-15-10-11-27-14-15)20(26)13-25-19-5-3-2-4-18(19)22-23-25/h2-11,14,21H,12-13H2,1H3
Definition date:	2023-08-15
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	2-(1H-benzotriazol-1-yl)-N-[4-(methylamino)phenyl]-N-[(thiophen-3-yl)methyl]acetamide

QGC

QGC
Name:	(4R)-6-chloro-N-(isoquinolin-4-yl)-1-[(4H-1,2,4-triazol-3-yl)methyl]-1,2,3,4-tetrahydroquinoline-4-carboxamide
Formula:	C22 H19 Cl N6 O
SMILES:	Clc1ccc2c(c1)C(CCN2Cc1nnc[NH]1)C(=O)Nc1cncc2ccccc21
InChi:	InChI=1S/C22H19ClN6O/c23-15-5-6-20-18(9-15)17(7-8-29(20)12-21-25-13-26-28-21)22(30)27-19-11-24-10-14-3-1-2-4-16(14)19/h1-6,9-11,13,17H,7-8,12H2,(H,27,30)(H,25,26,28)/t17-/m1/s1
Definition date:	2023-08-18
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	(4R)-6-chloro-N-(isoquinolin-4-yl)-1-[(4H-1,2,4-triazol-3-yl)methyl]-1,2,3,4-tetrahydroquinoline-4-carboxamide

R8I

R8I
Name:	(4S)-6-chloro-2-{2-[(cyanomethyl)amino]-2-oxoethyl}-N-(isoquinolin-4-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Formula:	C23 H20 Cl N5 O2
SMILES:	N#CCNC(=O)CN1Cc2ccc(Cl)cc2C(C1)C(=O)Nc1cncc2ccccc21
InChi:	InChI=1S/C23H20ClN5O2/c24-17-6-5-16-12-29(14-22(30)27-8-7-25)13-20(19(16)9-17)23(31)28-21-11-26-10-15-3-1-2-4-18(15)21/h1-6,9-11,20H,8,12-14H2,(H,27,30)(H,28,31)/t20-/m1/s1
Definition date:	2023-08-22
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	(4S)-6-chloro-2-{2-[(cyanomethyl)amino]-2-oxoethyl}-N-(isoquinolin-4-yl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide

Q1C

Q1C
Name:	2-(4-methylpiperidin-1-yl)-N-(4-methylpyridin-3-yl)acetamide
Formula:	C14 H21 N3 O
SMILES:	O=C(CN1CCC(C)CC1)Nc1cnccc1C
InChi:	InChI=1S/C14H21N3O/c1-11-4-7-17(8-5-11)10-14(18)16-13-9-15-6-3-12(13)2/h3,6,9,11H,4-5,7-8,10H2,1-2H3,(H,16,18)
Definition date:	2023-08-18
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	2-(4-methylpiperidin-1-yl)-N-(4-methylpyridin-3-yl)acetamide

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