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WL7
WL7
Name:4-amino-N-(2-hydroxyethyl)-N-methylbenzene-1-sulfonamide
Formula:C9 H14 N2 O3 S
SMILES:c1c(ccc(c1)N)S(N(C)CCO)(=O)=O
InChi:InChI=1S/C9H14N2O3S/c1-11(6-7-12)15(13,14)9-4-2-8(10)3-5-9/h2-5,12H,6-7,10H2,1H3
Definition date:2020-10-30
Last modified:2020-11-06
Release date:2020-11-11
Identifier:4-amino-N-(2-hydroxyethyl)-N-methylbenzene-1-sulfonamide
WLA
WLA
Name:1-[(oxan-4-yl)methyl]piperazine
Formula:C10 H20 N2 O
SMILES:C1CN(CCN1)CC2CCOCC2
InChi:InChI=1S/C10H20N2O/c1-7-13-8-2-10(1)9-12-5-3-11-4-6-12/h10-11H,1-9H2
Definition date:2020-10-30
Last modified:2020-11-06
Release date:2020-11-11
Identifier:1-[(oxan-4-yl)methyl]piperazine
WLD
WLD
Name:(2S)-1-{[(2,6-dichlorophenyl)methyl]amino}propan-2-ol
Formula:C10 H13 Cl2 N O
SMILES:c1c(c(c(cc1)Cl)CNCC(C)O)Cl
InChi:InChI=1S/C10H13Cl2NO/c1-7(14)5-13-6-8-9(11)3-2-4-10(8)12/h2-4,7,13-14H,5-6H2,1H3/t7-/m0/s1
Definition date:2020-10-30
Last modified:2020-11-06
Release date:2020-11-11
Identifier:(2S)-1-{[(2,6-dichlorophenyl)methyl]amino}propan-2-ol
WLG
WLG
Name:1-(5-azaspiro[2.5]octan-5-yl)-2-(difluoromethoxy)ethan-1-one
Formula:C10 H15 F2 N O2
SMILES:C2CN(CC1(CC1)C2)C(COC(F)F)=O
InChi:InChI=1S/C10H15F2NO2/c11-9(12)15-6-8(14)13-5-1-2-10(7-13)3-4-10/h9H,1-7H2
Definition date:2020-10-30
Last modified:2020-11-06
Release date:2020-11-11
Identifier:1-(5-azaspiro[2.5]octan-5-yl)-2-(difluoromethoxy)ethan-1-one
WLJ
WLJ
Name:(azepan-1-yl)(2,6-difluorophenyl)methanone
Formula:C13 H15 F2 N O
SMILES:C1CN(CCCC1)C(c2c(cccc2F)F)=O
InChi:InChI=1S/C13H15F2NO/c14-10-6-5-7-11(15)12(10)13(17)16-8-3-1-2-4-9-16/h5-7H,1-4,8-9H2
Definition date:2020-10-30
Last modified:2020-11-06
Release date:2020-11-11
Identifier:(azepan-1-yl)(2,6-difluorophenyl)methanone
WLS
WLS
Name:1-(pyridin-4-yl)-N-[(thiophen-2-yl)methyl]methanamine
Formula:C11 H12 N2 S
SMILES:c1(cccs1)CNCc2ccncc2
InChi:InChI=1S/C11H12N2S/c1-2-11(14-7-1)9-13-8-10-3-5-12-6-4-10/h1-7,13H,8-9H2
Definition date:2020-10-30
Last modified:2020-11-06
Release date:2020-11-11
Identifier:1-(pyridin-4-yl)-N-[(thiophen-2-yl)methyl]methanamine
WLV
WLV
Name:N-(3-fluorophenyl)-2-phenoxyacetamide
Formula:C14 H12 F N O2
SMILES:C(Oc1ccccc1)C(=O)Nc2cccc(c2)F
InChi:InChI=1S/C14H12FNO2/c15-11-5-4-6-12(9-11)16-14(17)10-18-13-7-2-1-3-8-13/h1-9H,10H2,(H,16,17)
Definition date:2020-10-30
Last modified:2020-11-06
Release date:2020-11-11
Identifier:N-(3-fluorophenyl)-2-phenoxyacetamide
WM7
WM7
Name:(3S)-N-benzylpyrrolidin-3-amine
Formula:C11 H16 N2
SMILES:c2cccc(CNC1CCNC1)c2
InChi:InChI=1S/C11H16N2/c1-2-4-10(5-3-1)8-13-11-6-7-12-9-11/h1-5,11-13H,6-9H2/t11-/m0/s1
Definition date:2020-10-30
Last modified:2020-11-06
Release date:2020-11-11
Identifier:(3S)-N-benzylpyrrolidin-3-amine
WMD
WMD
Name:1-[(1R)-1-(2-fluorophenyl)ethyl]piperazine
Formula:C12 H17 F N2
SMILES:c2c(C(C)N1CCNCC1)c(ccc2)F
InChi:InChI=1S/C12H17FN2/c1-10(15-8-6-14-7-9-15)11-4-2-3-5-12(11)13/h2-5,10,14H,6-9H2,1H3/t10-/m1/s1
Definition date:2020-10-30
Last modified:2020-11-06
Release date:2020-11-11
Identifier:1-[(1R)-1-(2-fluorophenyl)ethyl]piperazine
WMG
WMG
Name:1-[(1S)-1-(2-fluorophenyl)ethyl]piperazine
Formula:C12 H17 F N2
SMILES:c2c(C(C)N1CCNCC1)c(ccc2)F
InChi:InChI=1S/C12H17FN2/c1-10(15-8-6-14-7-9-15)11-4-2-3-5-12(11)13/h2-5,10,14H,6-9H2,1H3/t10-/m0/s1
Definition date:2020-10-30
Last modified:2020-11-06
Release date:2020-11-11
Identifier:1-[(1S)-1-(2-fluorophenyl)ethyl]piperazine
WMS
WMS
Name:5-fluoro-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridin-3-amine
Formula:C10 H10 F N3 S
SMILES:Cc1ncc(s1)CNc2cc(cnc2)F
InChi:InChI=1S/C10H10FN3S/c1-7-13-5-10(15-7)6-14-9-2-8(11)3-12-4-9/h2-5,14H,6H2,1H3
Definition date:2020-10-30
Last modified:2020-11-06
Release date:2020-11-11
Identifier:5-fluoro-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyridin-3-amine
WMV
WMV
Name:N-(2-cyclohexylethyl)-3,5-dimethyl-1,2-oxazole-4-carboxamide
Formula:C14 H22 N2 O2
SMILES:C2(CCNC(c1c(C)noc1C)=O)CCCCC2
InChi:InChI=1S/C14H22N2O2/c1-10-13(11(2)18-16-10)14(17)15-9-8-12-6-4-3-5-7-12/h12H,3-9H2,1-2H3,(H,15,17)
Definition date:2020-10-30
Last modified:2020-11-06
Release date:2020-11-11
Identifier:N-(2-cyclohexylethyl)-3,5-dimethyl-1,2-oxazole-4-carboxamide
WMY
WMY
Name:3-chloro-N-(1,2-oxazol-3-yl)benzamide
Formula:C10 H7 Cl N2 O2
SMILES:c1onc(c1)NC(c2cccc(c2)Cl)=O
InChi:InChI=1S/C10H7ClN2O2/c11-8-3-1-2-7(6-8)10(14)12-9-4-5-15-13-9/h1-6H,(H,12,13,14)
Definition date:2020-10-30
Last modified:2020-11-06
Release date:2020-11-11
Identifier:3-chloro-N-(1,2-oxazol-3-yl)benzamide
WNA
WNA
Name:1-methyl-N-[(2-methylphenyl)methyl]-1H-tetrazol-5-amine
Formula:C10 H13 N5
SMILES:c2(NCc1c(C)cccc1)nnnn2C
InChi:InChI=1S/C10H13N5/c1-8-5-3-4-6-9(8)7-11-10-12-13-14-15(10)2/h3-6H,7H2,1-2H3,(H,11,12,14)
Definition date:2020-10-30
Last modified:2020-11-06
Release date:2020-11-11
Identifier:1-methyl-N-[(2-methylphenyl)methyl]-1H-tetrazol-5-amine
WND
WND
Name:2-methyl-1-[(oxan-4-yl)amino]propan-2-ol
Formula:C9 H19 N O2
SMILES:CC(C)(CNC1CCOCC1)O
InChi:InChI=1S/C9H19NO2/c1-9(2,11)7-10-8-3-5-12-6-4-8/h8,10-11H,3-7H2,1-2H3
Definition date:2020-10-30
Last modified:2020-11-06
Release date:2020-11-11
Identifier:2-methyl-1-[(oxan-4-yl)amino]propan-2-ol
WNG
WNG
Name:N-[(Z)-2-phenylethenyl]-1H-benzimidazol-2-amine
Formula:C15 H13 N3
SMILES:c2(nc1c(cccc1)n2)N[C@H]=Cc3ccccc3
InChi:InChI=1S/C15H13N3/c1-2-6-12(7-3-1)10-11-16-15-17-13-8-4-5-9-14(13)18-15/h1-11H,(H2,16,17,18)/b11-10-
Definition date:2020-10-30
Last modified:2020-11-06
Release date:2020-11-11
Identifier:N-[(Z)-2-phenylethenyl]-1H-benzimidazol-2-amine
WNJ
WNJ
Name:N-{[(3R)-pyrrolidin-3-yl]methyl}pyridin-2-amine
Formula:C10 H15 N3
SMILES:C1CNCC1CNc2ccccn2
InChi:InChI=1S/C10H15N3/c1-2-5-12-10(3-1)13-8-9-4-6-11-7-9/h1-3,5,9,11H,4,6-8H2,(H,12,13)/t9-/m1/s1
Definition date:2020-10-30
Last modified:2020-11-06
Release date:2020-11-11
Identifier:N-{[(3R)-pyrrolidin-3-yl]methyl}pyridin-2-amine
WNM
WNM
Name:(3S)-1-(phenylsulfonyl)pyrrolidin-3-amine
Formula:C10 H14 N2 O2 S
SMILES:c2(S(N1CCC(N)C1)(=O)=O)ccccc2
InChi:InChI=1S/C10H14N2O2S/c11-9-6-7-12(8-9)15(13,14)10-4-2-1-3-5-10/h1-5,9H,6-8,11H2/t9-/m0/s1
Definition date:2020-10-30
Last modified:2020-11-06
Release date:2020-11-11
Identifier:(3S)-1-(phenylsulfonyl)pyrrolidin-3-amine
WNP
WNP
Name:N-(3-chlorophenyl)-2,2,2-trifluoroacetamide
Formula:C8 H5 Cl F3 N O
SMILES:c1cc(NC(C(F)(F)F)=O)cc(c1)Cl
InChi:InChI=1S/C8H5ClF3NO/c9-5-2-1-3-6(4-5)13-7(14)8(10,11)12/h1-4H,(H,13,14)
Definition date:2020-10-30
Last modified:2020-11-06
Release date:2020-11-11
Identifier:N-(3-chlorophenyl)-2,2,2-trifluoroacetamide
WNV
WNV
Name:N,N,2,3-tetramethylbenzamide
Formula:C11 H15 N O
SMILES:c1(cccc(C(=O)N(C)C)c1C)C
InChi:InChI=1S/C11H15NO/c1-8-6-5-7-10(9(8)2)11(13)12(3)4/h5-7H,1-4H3
Definition date:2020-10-30
Last modified:2020-11-06
Release date:2020-11-11
Identifier:N,N,2,3-tetramethylbenzamide
WNY
WNY
Name:1-[4-(4-chlorophenyl)piperazin-1-yl]ethan-1-one
Formula:C12 H15 Cl N2 O
SMILES:c2(N1CCN(C(C)=O)CC1)ccc(cc2)Cl
InChi:InChI=1S/C12H15ClN2O/c1-10(16)14-6-8-15(9-7-14)12-4-2-11(13)3-5-12/h2-5H,6-9H2,1H3
Definition date:2020-10-30
Last modified:2020-11-06
Release date:2020-11-11
Identifier:1-[4-(4-chlorophenyl)piperazin-1-yl]ethan-1-one
WO1
WO1
Name:(3R)-1-methylpiperidin-3-yl furan-2-carboxylate
Formula:C11 H15 N O3
SMILES:c2cc(C(=O)OC1CCCN(C)C1)oc2
InChi:InChI=1S/C11H15NO3/c1-12-6-2-4-9(8-12)15-11(13)10-5-3-7-14-10/h3,5,7,9H,2,4,6,8H2,1H3/t9-/m1/s1
Definition date:2020-10-30
Last modified:2020-11-06
Release date:2020-11-11
Identifier:(3R)-1-methylpiperidin-3-yl furan-2-carboxylate
WO7
WO7
Name:1-(1,4-diazepan-1-yl)ethan-1-one
Formula:C7 H14 N2 O
SMILES:C1CNCCCN1C(C)=O
InChi:InChI=1S/C7H14N2O/c1-7(10)9-5-2-3-8-4-6-9/h8H,2-6H2,1H3
Definition date:2020-10-30
Last modified:2020-11-06
Release date:2020-11-11
Identifier:1-(1,4-diazepan-1-yl)ethan-1-one
WOA
WOA
Name:(3S)-3-(methylamino)-1-phenylpiperidin-2-one
Formula:C12 H16 N2 O
SMILES:c2(N1CCCC(NC)C1=O)ccccc2
InChi:InChI=1S/C12H16N2O/c1-13-11-8-5-9-14(12(11)15)10-6-3-2-4-7-10/h2-4,6-7,11,13H,5,8-9H2,1H3/t11-/m0/s1
Definition date:2020-10-30
Last modified:2020-11-06
Release date:2020-11-11
Identifier:(3S)-3-(methylamino)-1-phenylpiperidin-2-one
WOD
WOD
Name:3-cyclopropyl-5-[(3R)-pyrrolidin-3-yl]-1,2,4-oxadiazole
Formula:C9 H13 N3 O
SMILES:C1C(CNC1)c3onc(C2CC2)n3
InChi:InChI=1S/C9H13N3O/c1-2-6(1)8-11-9(13-12-8)7-3-4-10-5-7/h6-7,10H,1-5H2/t7-/m1/s1
Definition date:2020-10-30
Last modified:2020-11-06
Release date:2020-11-11
Identifier:3-cyclopropyl-5-[(3R)-pyrrolidin-3-yl]-1,2,4-oxadiazole

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数据于2025-07-09公开中

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