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T81
T81
表記:1-{4-[(5-bromothiophen-2-yl)methyl]piperazin-1-yl}ethan-1-one
組成式:C11 H15 Br N2 O S
SMILES:N1(CCN(CC1)C(C)=O)Cc2ccc(s2)Br
InChi:InChI=1S/C11H15BrN2OS/c1-9(15)14-6-4-13(5-7-14)8-10-2-3-11(12)16-10/h2-3H,4-8H2,1H3
定義日:2020-03-16
最終更新日:2020-03-20
公開日:2020-03-25
識別子（ID）:1-{4-[(5-bromothiophen-2-yl)methyl]piperazin-1-yl}ethan-1-one
T84
T84
表記:1-{4-[(thiophen-3-yl)methyl]piperazin-1-yl}ethan-1-one
組成式:C11 H16 N2 O S
SMILES:N1(CCN(CC1)C(C)=O)Cc2ccsc2
InChi:InChI=1S/C11H16N2OS/c1-10(14)13-5-3-12(4-6-13)8-11-2-7-15-9-11/h2,7,9H,3-6,8H2,1H3
定義日:2020-03-16
最終更新日:2020-03-20
公開日:2020-03-25
識別子（ID）:1-{4-[(thiophen-3-yl)methyl]piperazin-1-yl}ethan-1-one
T8A
T8A
表記:1-[(4S)-4-phenyl-3,4-dihydroisoquinolin-2(1H)-yl]ethan-1-one
組成式:C17 H17 N O
SMILES:c2cc3C(c1ccccc1)CN(C(C)=O)Cc3cc2
InChi:InChI=1S/C17H17NO/c1-13(19)18-11-15-9-5-6-10-16(15)17(12-18)14-7-3-2-4-8-14/h2-10,17H,11-12H2,1H3/t17-/m0/s1
定義日:2020-03-16
最終更新日:2020-03-20
公開日:2020-03-25
識別子（ID）:1-[(4S)-4-phenyl-3,4-dihydroisoquinolin-2(1H)-yl]ethan-1-one
T8D
T8D
表記:1-{4-[(5-chlorothiophen-2-yl)sulfonyl]piperazin-1-yl}ethan-1-one
組成式:C10 H13 Cl N2 O3 S2
SMILES:N1(CCN(CC1)C(C)=O)S(c2ccc(s2)Cl)(=O)=O
InChi:InChI=1S/C10H13ClN2O3S2/c1-8(14)12-4-6-13(7-5-12)18(15,16)10-3-2-9(11)17-10/h2-3H,4-7H2,1H3
定義日:2020-03-16
最終更新日:2020-03-20
公開日:2020-03-25
識別子（ID）:1-{4-[(5-chlorothiophen-2-yl)sulfonyl]piperazin-1-yl}ethan-1-one
T8J
T8J
表記:1-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethan-1-one
組成式:C11 H14 N2 O2 S
SMILES:N1(CCN(CC1)C(C)=O)C(c2cccs2)=O
InChi:InChI=1S/C11H14N2O2S/c1-9(14)12-4-6-13(7-5-12)11(15)10-3-2-8-16-10/h2-3,8H,4-7H2,1H3
定義日:2020-03-16
最終更新日:2020-03-20
公開日:2020-03-25
識別子（ID）:1-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethan-1-one
T8M
T8M
表記:1-{4-[(thiophen-2-yl)methyl]piperazin-1-yl}ethan-1-one
組成式:C11 H16 N2 O S
SMILES:N1(CCN(CC1)C(C)=O)Cc2cccs2
InChi:InChI=1S/C11H16N2OS/c1-10(14)13-6-4-12(5-7-13)9-11-3-2-8-15-11/h2-3,8H,4-7,9H2,1H3
定義日:2020-03-16
最終更新日:2020-03-20
公開日:2020-03-25
識別子（ID）:1-{4-[(thiophen-2-yl)methyl]piperazin-1-yl}ethan-1-one
T8P
T8P
表記:1-[4-(4-methoxyphenyl)piperazin-1-yl]ethan-1-one
組成式:C13 H18 N2 O2
SMILES:N2(CCN(c1ccc(cc1)OC)CC2)C(=O)C
InChi:InChI=1S/C13H18N2O2/c1-11(16)14-7-9-15(10-8-14)12-3-5-13(17-2)6-4-12/h3-6H,7-10H2,1-2H3
定義日:2020-03-16
最終更新日:2020-03-20
公開日:2020-03-25
識別子（ID）:1-[4-(4-methoxyphenyl)piperazin-1-yl]ethan-1-one
T8S
T8S
表記:1-acetyl-N-methyl-N-(propan-2-yl)piperidine-4-carboxamide
組成式:C12 H22 N2 O2
SMILES:N1(CCC(C(N(C(C)C)C)=O)CC1)C(=O)C
InChi:InChI=1S/C12H22N2O2/c1-9(2)13(4)12(16)11-5-7-14(8-6-11)10(3)15/h9,11H,5-8H2,1-4H3
定義日:2020-03-16
最終更新日:2020-03-20
公開日:2020-03-25
識別子（ID）:1-acetyl-N-methyl-N-(propan-2-yl)piperidine-4-carboxamide
T8V
T8V
表記:N-(2-chloropyridin-3-yl)acetamide
組成式:C7 H7 Cl N2 O
SMILES:n1cccc(c1Cl)NC(C)=O
InChi:InChI=1S/C7H7ClN2O/c1-5(11)10-6-3-2-4-9-7(6)8/h2-4H,1H3,(H,10,11)
定義日:2020-03-16
最終更新日:2020-03-20
公開日:2020-03-25
識別子（ID）:N-(2-chloropyridin-3-yl)acetamide
T8Y
T8Y
表記:1,1'-(piperazine-1,4-diyl)di(ethan-1-one)
組成式:C8 H14 N2 O2
SMILES:N1(CCN(CC1)C(C)=O)C(=O)C
InChi:InChI=1S/C8H14N2O2/c1-7(11)9-3-5-10(6-4-9)8(2)12/h3-6H2,1-2H3
定義日:2020-03-16
最終更新日:2020-03-20
公開日:2020-03-25
識別子（ID）:1,1'-(piperazine-1,4-diyl)di(ethan-1-one)
SZY
SZY
表記:N-(4-methylpyridin-3-yl)acetamide
組成式:C8 H10 N2 O
SMILES:c1(ccncc1NC(C)=O)C
InChi:InChI=1S/C8H10N2O/c1-6-3-4-9-5-8(6)10-7(2)11/h3-5H,1-2H3,(H,10,11)
定義日:2020-03-16
最終更新日:2020-03-20
公開日:2020-03-25
識別子（ID）:N-(4-methylpyridin-3-yl)acetamide
T0J
T0J
表記:N~1~-phenylpiperidine-1,4-dicarboxamide
組成式:C13 H17 N3 O2
SMILES:C(N1CCC(C(N)=O)CC1)(Nc2ccccc2)=O
InChi:InChI=1S/C13H17N3O2/c14-12(17)10-6-8-16(9-7-10)13(18)15-11-4-2-1-3-5-11/h1-5,10H,6-9H2,(H2,14,17)(H,15,18)
定義日:2020-03-16
最終更新日:2020-03-20
公開日:2020-03-25
識別子（ID）:N~1~-phenylpiperidine-1,4-dicarboxamide
T0S
T0S
表記:N-[(4-sulfamoylphenyl)methyl]acetamide
組成式:C9 H12 N2 O3 S
SMILES:c1c(ccc(CNC(C)=O)c1)S(N)(=O)=O
InChi:InChI=1S/C9H12N2O3S/c1-7(12)11-6-8-2-4-9(5-3-8)15(10,13)14/h2-5H,6H2,1H3,(H,11,12)(H2,10,13,14)
定義日:2020-03-16
最終更新日:2020-03-20
公開日:2020-03-25
識別子（ID）:N-[(4-sulfamoylphenyl)methyl]acetamide
T1J
T1J
表記:2-{[(1H-benzimidazol-2-yl)amino]methyl}phenol
組成式:C14 H13 N3 O
SMILES:c3(NCc1c(O)cccc1)nc2ccccc2n3
InChi:InChI=1S/C14H13N3O/c18-13-8-4-1-5-10(13)9-15-14-16-11-6-2-3-7-12(11)17-14/h1-8,18H,9H2,(H2,15,16,17)
定義日:2020-03-16
最終更新日:2020-03-20
公開日:2020-03-25
識別子（ID）:2-{[(1H-benzimidazol-2-yl)amino]methyl}phenol
T1M
T1M
表記:(2R,3R)-1-benzyl-2-methylpiperidin-3-ol
組成式:C13 H19 N O
SMILES:c2(CN1C(C)C(CCC1)O)ccccc2
InChi:InChI=1S/C13H19NO/c1-11-13(15)8-5-9-14(11)10-12-6-3-2-4-7-12/h2-4,6-7,11,13,15H,5,8-10H2,1H3/t11-,13+/m1/s1
定義日:2020-03-16
最終更新日:2020-03-20
公開日:2020-03-25
識別子（ID）:(2R,3R)-1-benzyl-2-methylpiperidin-3-ol
T1V
T1V
表記:1-{4-[(thiophen-2-yl)sulfonyl]piperazin-1-yl}ethan-1-one
組成式:C10 H14 N2 O3 S2
SMILES:N1(CCN(CC1)C(C)=O)S(c2cccs2)(=O)=O
InChi:InChI=1S/C10H14N2O3S2/c1-9(13)11-4-6-12(7-5-11)17(14,15)10-3-2-8-16-10/h2-3,8H,4-7H2,1H3
定義日:2020-03-16
最終更新日:2020-03-20
公開日:2020-03-25
識別子（ID）:1-{4-[(thiophen-2-yl)sulfonyl]piperazin-1-yl}ethan-1-one
T1Y
T1Y
表記:1-{4-[(3-fluorophenyl)sulfonyl]piperazin-1-yl}ethan-1-one
組成式:C12 H15 F N2 O3 S
SMILES:N2(CCN(S(c1cccc(c1)F)(=O)=O)CC2)C(=O)C
InChi:InChI=1S/C12H15FN2O3S/c1-10(16)14-5-7-15(8-6-14)19(17,18)12-4-2-3-11(13)9-12/h2-4,9H,5-8H2,1H3
定義日:2020-03-16
最終更新日:2020-03-20
公開日:2020-03-25
識別子（ID）:1-{4-[(3-fluorophenyl)sulfonyl]piperazin-1-yl}ethan-1-one
T2G
T2G
表記:1-{4-[(3-methylphenyl)methyl]piperazin-1-yl}ethan-1-one
組成式:C14 H20 N2 O
SMILES:N2(CCN(Cc1cccc(c1)C)CC2)C(=O)C
InChi:InChI=1S/C14H20N2O/c1-12-4-3-5-14(10-12)11-15-6-8-16(9-7-15)13(2)17/h3-5,10H,6-9,11H2,1-2H3
定義日:2020-03-16
最終更新日:2020-03-20
公開日:2020-03-25
識別子（ID）:1-{4-[(3-methylphenyl)methyl]piperazin-1-yl}ethan-1-one
T2V
T2V
表記:1-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]ethan-1-one
組成式:C14 H16 N2 O S
SMILES:n2c(C1CCCN(C1)C(C)=O)sc3c2cccc3
InChi:InChI=1S/C14H16N2OS/c1-10(17)16-8-4-5-11(9-16)14-15-12-6-2-3-7-13(12)18-14/h2-3,6-7,11H,4-5,8-9H2,1H3/t11-/m1/s1
定義日:2020-03-16
最終更新日:2020-03-20
公開日:2020-03-25
識別子（ID）:1-[(3R)-3-(1,3-benzothiazol-2-yl)piperidin-1-yl]ethan-1-one
T2Y
T2Y
表記:N-[(2H-1,3-benzodioxol-5-yl)methyl]acetamide
組成式:C10 H11 N O3
SMILES:c2cc1c(OCO1)cc2CNC(C)=O
InChi:InChI=1S/C10H11NO3/c1-7(12)11-5-8-2-3-9-10(4-8)14-6-13-9/h2-4H,5-6H2,1H3,(H,11,12)
定義日:2020-03-16
最終更新日:2020-03-20
公開日:2020-03-25
識別子（ID）:N-[(2H-1,3-benzodioxol-5-yl)methyl]acetamide
T3G
T3G
表記:1-{4-[(2,6-difluorophenyl)sulfonyl]piperazin-1-yl}ethan-1-one
組成式:C12 H14 F2 N2 O3 S
SMILES:N2(CCN(S(c1c(cccc1F)F)(=O)=O)CC2)C(=O)C
InChi:InChI=1S/C12H14F2N2O3S/c1-9(17)15-5-7-16(8-6-15)20(18,19)12-10(13)3-2-4-11(12)14/h2-4H,5-8H2,1H3
定義日:2020-03-16
最終更新日:2020-03-20
公開日:2020-03-25
識別子（ID）:1-{4-[(2,6-difluorophenyl)sulfonyl]piperazin-1-yl}ethan-1-one
T3J
T3J
表記:1-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]ethan-1-one
組成式:C12 H14 F N O2
SMILES:c1(ccc(F)cc1)C2CN(C(C)=O)CCO2
InChi:InChI=1S/C12H14FNO2/c1-9(15)14-6-7-16-12(8-14)10-2-4-11(13)5-3-10/h2-5,12H,6-8H2,1H3/t12-/m0/s1
定義日:2020-03-16
最終更新日:2020-03-20
公開日:2020-03-25
識別子（ID）:1-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]ethan-1-one
T3V
T3V
表記:1-{4-[(2-fluorophenyl)sulfonyl]piperazin-1-yl}ethan-1-one
組成式:C12 H15 F N2 O3 S
SMILES:N2(CCN(S(c1ccccc1F)(=O)=O)CC2)C(=O)C
InChi:InChI=1S/C12H15FN2O3S/c1-10(16)14-6-8-15(9-7-14)19(17,18)12-5-3-2-4-11(12)13/h2-5H,6-9H2,1H3
定義日:2020-03-16
最終更新日:2020-03-20
公開日:2020-03-25
識別子（ID）:1-{4-[(2-fluorophenyl)sulfonyl]piperazin-1-yl}ethan-1-one
T47
T47
表記:1-{4-[(3-chlorophenyl)methyl]piperazin-1-yl}ethan-1-one
組成式:C13 H17 Cl N2 O
SMILES:N1(CCN(C(C)=O)CC1)Cc2cccc(c2)Cl
InChi:InChI=1S/C13H17ClN2O/c1-11(17)16-7-5-15(6-8-16)10-12-3-2-4-13(14)9-12/h2-4,9H,5-8,10H2,1H3
定義日:2020-03-16
最終更新日:2020-03-20
公開日:2020-03-25
識別子（ID）:1-{4-[(3-chlorophenyl)methyl]piperazin-1-yl}ethan-1-one
T4D
T4D
表記:2-[(4-acetylpiperazin-1-yl)sulfonyl]benzonitrile
組成式:C13 H15 N3 O3 S
SMILES:N1(CCN(CC1)C(C)=O)S(c2ccccc2C#N)(=O)=O
InChi:InChI=1S/C13H15N3O3S/c1-11(17)15-6-8-16(9-7-15)20(18,19)13-5-3-2-4-12(13)10-14/h2-5H,6-9H2,1H3
定義日:2020-03-16
最終更新日:2020-03-20
公開日:2020-03-25
識別子（ID）:2-[(4-acetylpiperazin-1-yl)sulfonyl]benzonitrile

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件を2024-07-17に公開中

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