N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-2,3-dihydro-1-benzofuran-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-2H-chromene-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-5-pyridin-2-yl-1,3-dihydroisoindole-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-7-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N,3,3-trimethyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-1H-isoindole-2-carboxamide

C119H122N28O20S12 — CID 161369691

IUPACN-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-2,3-dihydro-1-benzofuran-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-2H-chromene-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-5-pyridin-2-yl-1,3-dihydroisoindole-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-7-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N,3,3-trimethyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-1H-isoindole-2-carboxamide
SMILESCc1nc(N(C)C(=O)C2COc3cc(-c4ccccn4)ccc32)sc1S(N)(=O)=O.Cc1nc(N(C)C(=O)C2COc3ccc(-c4ccccn4)cc3C2)sc1S(N)(=O)=O.Cc1nc(N(C)C(=O)N2CCc3cc(-c4ccccn4)ccc3C2)sc1S(N)(=O)=O.Cc1nc(N(C)C(=O)N2CCc3ccc(-c4ccccn4)cc3C2)sc1S(N)(=O)=O.Cc1nc(N(C)C(=O)N2Cc3cc(-c4ccccn4)ccc3C2(C)C)sc1S(N)(=O)=O.Cc1nc(N(C)C(=O)N2Cc3ccc(-c4ccccn4)cc3C2)sc1S(N)(=O)=O
InChIInChI=1S/C21H23N5O3S2.2C20H21N5O3S2.C20H20N4O4S2.C19H19N5O3S2.C19H18N4O4S2/c1-13-18(31(22,28)29)30-19(24-13)25(4)20(27)26-12-15-11-14(17-7-5-6-10-23-17)8-9-16(15)21(26,2)3;1-13-18(30(21,27)28)29-19(23-13)24(2)20(26)25-10-8-14-11-15(6-7-16(14)12-25)17-5-3-4-9-22-17;1-13-18(30(21,27)28)29-19(23-13)24(2)20(26)25-10-8-14-6-7-15(11-16(14)12-25)17-5-3-4-9-22-17;1-12-19(30(21,26)27)29-20(23-12)24(2)18(25)15-10-14-9-13(6-7-17(14)28-11-15)16-5-3-4-8-22-16;1-12-17(29(20,26)27)28-18(22-12)23(2)19(25)24-10-14-7-6-13(9-15(14)11-24)16-5-3-4-8-21-16;1-11-18(29(20,25)26)28-19(22-11)23(2)17(24)14-10-27-16-9-12(6-7-13(14)16)15-5-3-4-8-21-15/h5-11H,12H2,1-4H3,(H2,22,28,29);2*3-7,9,11H,8,10,12H2,1-2H3,(H2,21,27,28);3-9,15H,10-11H2,1-2H3,(H2,21,26,27);3-9H,10-11H2,1-2H3,(H2,20,26,27);3-9,14H,10H2,1-2H3,(H2,20,25,26)
InChIKeyVQHLGXBXHNNDPT-UHFFFAOYSA-N
MW2649.26 g/mol
LogP16.43
Rot. Bonds20

About N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-2,3-dihydro-1-benzofuran-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-2H-chromene-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-5-pyridin-2-yl-1,3-dihydroisoindole-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-7-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N,3,3-trimethyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-1H-isoindole-2-carboxamide

N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-2,3-dihydro-1-benzofuran-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-2H-chromene-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-5-pyridin-2-yl-1,3-dihydroisoindole-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-7-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N,3,3-trimethyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-1H-isoindole-2-carboxamide (PubChem CID 161369691) has the molecular formula C119H122N28O20S12 and a molecular weight of 2649.26 g/mol. Its IUPAC name is N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-2,3-dihydro-1-benzofuran-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-2H-chromene-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-5-pyridin-2-yl-1,3-dihydroisoindole-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-7-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N,3,3-trimethyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-1H-isoindole-2-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-2,3-dihydro-1-benzofuran-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-2H-chromene-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-5-pyridin-2-yl-1,3-dihydroisoindole-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-7-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N,3,3-trimethyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-1H-isoindole-2-carboxamide
PubChem CID161369691
Molecular FormulaC119H122N28O20S12
Molecular Weight2649.26 g/mol
Exact Mass2646.60
IUPAC NameN-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-2,3-dihydro-1-benzofuran-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-2H-chromene-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-5-pyridin-2-yl-1,3-dihydroisoindole-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-7-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N,3,3-trimethyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-1H-isoindole-2-carboxamide
SMILESCc1nc(N(C)C(=O)C2COc3cc(-c4ccccn4)ccc32)sc1S(N)(=O)=O.Cc1nc(N(C)C(=O)C2COc3ccc(-c4ccccn4)cc3C2)sc1S(N)(=O)=O.Cc1nc(N(C)C(=O)N2CCc3cc(-c4ccccn4)ccc3C2)sc1S(N)(=O)=O.Cc1nc(N(C)C(=O)N2CCc3ccc(-c4ccccn4)cc3C2)sc1S(N)(=O)=O.Cc1nc(N(C)C(=O)N2Cc3cc(-c4ccccn4)ccc3C2(C)C)sc1S(N)(=O)=O.Cc1nc(N(C)C(=O)N2Cc3ccc(-c4ccccn4)cc3C2)sc1S(N)(=O)=O
InChIInChI=1S/C21H23N5O3S2.2C20H21N5O3S2.C20H20N4O4S2.C19H19N5O3S2.C19H18N4O4S2/c1-13-18(31(22,28)29)30-19(24-13)25(4)20(27)26-12-15-11-14(17-7-5-6-10-23-17)8-9-16(15)21(26,2)3;1-13-18(30(21,27)28)29-19(23-13)24(2)20(26)25-10-8-14-11-15(6-7-16(14)12-25)17-5-3-4-9-22-17;1-13-18(30(21,27)28)29-19(23-13)24(2)20(26)25-10-8-14-6-7-15(11-16(14)12-25)17-5-3-4-9-22-17;1-12-19(30(21,26)27)29-20(23-12)24(2)18(25)15-10-14-9-13(6-7-17(14)28-11-15)16-5-3-4-8-22-16;1-12-17(29(20,26)27)28-18(22-12)23(2)19(25)24-10-14-7-6-13(9-15(14)11-24)16-5-3-4-8-21-16;1-11-18(29(20,25)26)28-19(22-11)23(2)17(24)14-10-27-16-9-12(6-7-13(14)16)15-5-3-4-8-21-15/h5-11H,12H2,1-4H3,(H2,22,28,29);2*3-7,9,11H,8,10,12H2,1-2H3,(H2,21,27,28);3-9,15H,10-11H2,1-2H3,(H2,21,26,27);3-9H,10-11H2,1-2H3,(H2,20,26,27);3-9,14H,10H2,1-2H3,(H2,20,25,26)
InChIKeyVQHLGXBXHNNDPT-UHFFFAOYSA-N
XLogP16.43
TPSA668.92 Ų
H-Bond Donors6
H-Bond Acceptors38
Rotatable Bonds20
Heavy Atoms179
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002649.26
LogP ≤ 516.43
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1038

Analyze N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-2,3-dihydro-1-benzofuran-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-2H-chromene-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-5-pyridin-2-yl-1,3-dihydroisoindole-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-7-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N,3,3-trimethyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-1H-isoindole-2-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)benzamide;2-(2,5-dimethoxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;4-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)benzamide;2-(1,3-dioxoisoindol-2-yl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-fluoro-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)benzamide;2-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide
CID 157612207
2-[1-(5-fluoro-6-pyridin-2-yl-2,3-dihydro-1H-inden-2-yl)ethyl-methylamino]-4-methyl-1,3-thiazole-5-sulfonamide;methane;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-5-pyridin-2-yl-2,3-dihydro-1H-indene-1-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-5-pyridin-2-yl-2,3-dihydro-1H-indene-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-5-pyridin-2-yloxy-2,3-dihydro-1H-indene-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-1,2,3,4-tetrahydronaphthalene-1-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-7-pyridin-2-yl-1,2,3,4-tetrahydronaphthalene-2-carboxamide
CID 158253322
N-[5-(cyclopropylsulfamoyl)-4-methyl-1,3-thiazol-2-yl]-N-methyl-5-pyridin-2-yl-2,3-dihydro-1H-indene-2-carboxamide;N,2-dimethyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-5-pyridin-2-yl-1,3-dihydroindene-2-carboxamide;2-(hydroxymethyl)-N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-5-pyridin-2-yl-1,3-dihydroindene-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-2H-chromene-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-4-pyridin-2-yl-2,3-dihydro-1H-indene-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-8-pyridin-2-yl-2,3,4,5-tetrahydro-1-benzoxepine-4-carboxamide
CID 159127968
4-Ethoxy-3-[(4-pyridin-3-yl-1,3-thiazol-2-yl)methyl]benzamide;1-[4-methoxy-2-methyl-5-[[4-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-1,3-thiazol-2-yl]methyl]phenyl]ethanone;1-[3-methoxy-4-[(4-pyridin-3-yl-1,3-thiazol-2-yl)methyl]phenyl]ethanone;1-[4-methoxy-3-[(4-pyridin-3-yl-1,3-thiazol-2-yl)methyl]phenyl]ethanone;1-[4-methoxy-3-[(4-pyridin-3-yl-1,3-thiazol-2-yl)methyl]phenyl]propan-2-one;2-[(2-methyl-1-benzofuran-7-yl)methyl]-4-pyridin-3-yl-1,3-thiazole;4-propan-2-yloxy-3-[(4-pyridin-3-yl-1,3-thiazol-2-yl)methyl]benzamide
CID 159458048

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-2,3-dihydro-1-benzofuran-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-2H-chromene-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-5-pyridin-2-yl-1,3-dihydroisoindole-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-7-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N,3,3-trimethyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-1H-isoindole-2-carboxamide?
The IUPAC name of N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-2,3-dihydro-1-benzofuran-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-2H-chromene-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-5-pyridin-2-yl-1,3-dihydroisoindole-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-7-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N,3,3-trimethyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-1H-isoindole-2-carboxamide (CID 161369691) is N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-2,3-dihydro-1-benzofuran-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-2H-chromene-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-5-pyridin-2-yl-1,3-dihydroisoindole-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-7-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N,3,3-trimethyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-1H-isoindole-2-carboxamide.
What is the SMILES notation for N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-2,3-dihydro-1-benzofuran-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-2H-chromene-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-5-pyridin-2-yl-1,3-dihydroisoindole-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-7-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N,3,3-trimethyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-1H-isoindole-2-carboxamide?
The canonical SMILES for N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-2,3-dihydro-1-benzofuran-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-2H-chromene-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-5-pyridin-2-yl-1,3-dihydroisoindole-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-7-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N,3,3-trimethyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-1H-isoindole-2-carboxamide is Cc1nc(N(C)C(=O)C2COc3cc(-c4ccccn4)ccc32)sc1S(N)(=O)=O.Cc1nc(N(C)C(=O)C2COc3ccc(-c4ccccn4)cc3C2)sc1S(N)(=O)=O.Cc1nc(N(C)C(=O)N2CCc3cc(-c4ccccn4)ccc3C2)sc1S(N)(=O)=O.Cc1nc(N(C)C(=O)N2CCc3ccc(-c4ccccn4)cc3C2)sc1S(N)(=O)=O.Cc1nc(N(C)C(=O)N2Cc3cc(-c4ccccn4)ccc3C2(C)C)sc1S(N)(=O)=O.Cc1nc(N(C)C(=O)N2Cc3ccc(-c4ccccn4)cc3C2)sc1S(N)(=O)=O.
What is the InChIKey of N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-2,3-dihydro-1-benzofuran-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-2H-chromene-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-5-pyridin-2-yl-1,3-dihydroisoindole-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-7-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N,3,3-trimethyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-1H-isoindole-2-carboxamide?
The InChIKey is VQHLGXBXHNNDPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N5O3S2.2C20H21N5O3S2.C20H20N4O4S2.C19H19N5O3S2.C19H18N4O4S2/c1-13-18(31(22,28)29)30-19(24-13)25(4)20(27)26-12-15-11-14(17-7-5-6-10-23-17)8-9-16(15)21(26,2)3;1-13-18(30(21,27)28)29-19(23-13)24(2)20(26)25-10-8-14-11-15(6-7-16(14)12-25)17-5-3-4-9-22-17;1-13-18(30(21,27)28)29-19(23-13)24(2)20(26)25-10-8-14-6-7-15(11-16(14)12-25)17-5-3-4-9-22-17;1-12-19(30(21,26)27)29-20(23-12)24(2)18(25)15-10-14-9-13(6-7-17(14)28-11-15)16-5-3-4-8-22-16;1-12-17(29(20,26)27)28-18(22-12)23(2)19(25)24-10-14-7-6-13(9-15(14)11-24)16-5-3-4-8-21-16;1-11-18(29(20,25)26)28-19(22-11)23(2)17(24)14-10-27-16-9-12(6-7-13(14)16)15-5-3-4-8-21-15/h5-11H,12H2,1-4H3,(H2,22,28,29);2*3-7,9,11H,8,10,12H2,1-2H3,(H2,21,27,28);3-9,15H,10-11H2,1-2H3,(H2,21,26,27);3-9H,10-11H2,1-2H3,(H2,20,26,27);3-9,14H,10H2,1-2H3,(H2,20,25,26).
What are the key properties of N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-2,3-dihydro-1-benzofuran-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-2H-chromene-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-5-pyridin-2-yl-1,3-dihydroisoindole-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-7-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N,3,3-trimethyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-1H-isoindole-2-carboxamide?
N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-2,3-dihydro-1-benzofuran-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-2H-chromene-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-5-pyridin-2-yl-1,3-dihydroisoindole-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-7-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N,3,3-trimethyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-1H-isoindole-2-carboxamide has a molecular weight of 2649.26 g/mol, XLogP of 16.43, 20 rotatable bonds, 6 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-2,3-dihydro-1-benzofuran-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-2H-chromene-3-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-5-pyridin-2-yl-1,3-dihydroisoindole-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-7-pyridin-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxamide;N,3,3-trimethyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)-6-pyridin-2-yl-1H-isoindole-2-carboxamide is sourced from PubChem (CID 161369691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).