N-[1-(benzenesulfonyl)pyrrol-3-yl]-1,3-thiazole-2-carboxamide;N-(1-benzylsulfonylpyrrol-3-yl)pyridine-2-carboxamide;N-[1-[(2-chlorophenyl)methylsulfonyl]pyrrol-3-yl]-1,3-thiazole-2-carboxamide;methane;N-[1-[(3-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;2-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]-1-(1,3-thiazol-2-yl)ethanone;N-[1-[4-(trifluoromethyl)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide

C116H102ClF3N20O21S10 — CID 159272917

About N-[1-(benzenesulfonyl)pyrrol-3-yl]-1,3-thiazole-2-carboxamide;N-(1-benzylsulfonylpyrrol-3-yl)pyridine-2-carboxamide;N-[1-[(2-chlorophenyl)methylsulfonyl]pyrrol-3-yl]-1,3-thiazole-2-carboxamide;methane;N-[1-[(3-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;2-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]-1-(1,3-thiazol-2-yl)ethanone;N-[1-[4-(trifluoromethyl)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide

N-[1-(benzenesulfonyl)pyrrol-3-yl]-1,3-thiazole-2-carboxamide;N-(1-benzylsulfonylpyrrol-3-yl)pyridine-2-carboxamide;N-[1-[(2-chlorophenyl)methylsulfonyl]pyrrol-3-yl]-1,3-thiazole-2-carboxamide;methane;N-[1-[(3-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;2-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]-1-(1,3-thiazol-2-yl)ethanone;N-[1-[4-(trifluoromethyl)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide (PubChem CID 159272917) has the molecular formula C116H102ClF3N20O21S10 and a molecular weight of 2525.33 g/mol. Its IUPAC name is N-[1-(benzenesulfonyl)pyrrol-3-yl]-1,3-thiazole-2-carboxamide;N-(1-benzylsulfonylpyrrol-3-yl)pyridine-2-carboxamide;N-[1-[(2-chlorophenyl)methylsulfonyl]pyrrol-3-yl]-1,3-thiazole-2-carboxamide;methane;N-[1-[(3-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;2-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]-1-(1,3-thiazol-2-yl)ethanone;N-[1-[4-(trifluoromethyl)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide.

Molecular Properties

• Compound Name: N-[1-(benzenesulfonyl)pyrrol-3-yl]-1,3-thiazole-2-carboxamide;N-(1-benzylsulfonylpyrrol-3-yl)pyridine-2-carboxamide;N-[1-[(2-chlorophenyl)methylsulfonyl]pyrrol-3-yl]-1,3-thiazole-2-carboxamide;methane;N-[1-[(3-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;2-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]-1-(1,3-thiazol-2-yl)ethanone;N-[1-[4-(trifluoromethyl)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide
• PubChem CID: 159272917
• Molecular Formula: C116H102ClF3N20O21S10
• Molecular Weight: 2525.33 g/mol
• Exact Mass: 2522.44
• IUPAC Name: N-[1-(benzenesulfonyl)pyrrol-3-yl]-1,3-thiazole-2-carboxamide;N-(1-benzylsulfonylpyrrol-3-yl)pyridine-2-carboxamide;N-[1-[(2-chlorophenyl)methylsulfonyl]pyrrol-3-yl]-1,3-thiazole-2-carboxamide;methane;N-[1-[(3-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;2-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]-1-(1,3-thiazol-2-yl)ethanone;N-[1-[4-(trifluoromethyl)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide
• SMILES: C.Cc1ccc(CS(=O)(=O)n2ccc(NC(=O)c3ccccn3)c2)cc1.Cc1ccc(S(=O)(=O)n2ccc(CC(=O)c3nccs3)c2)cc1.Cc1cccc(CS(=O)(=O)n2ccc(NC(=O)c3ccccn3)c2)c1.O=C(Nc1ccn(S(=O)(=O)Cc2ccccc2)c1)c1ccccn1.O=C(Nc1ccn(S(=O)(=O)Cc2ccccc2Cl)c1)c1nccs1.O=C(Nc1ccn(S(=O)(=O)c2ccc(C(F)(F)F)cc2)c1)c1ccccn1.O=C(Nc1ccn(S(=O)(=O)c2ccccc2)c1)c1nccs1
• InChI: InChI=1S/2C18H17N3O3S.C17H12F3N3O3S.C17H15N3O3S.C16H14N2O3S2.C15H12ClN3O3S2.C14H11N3O3S2.CH4/c1-14-5-4-6-15(11-14)13-25(23,24)21-10-8-16(12-21)20-18(22)17-7-2-3-9-19-17;1-14-5-7-15(8-6-14)13-25(23,24)21-11-9-16(12-21)20-18(22)17-4-2-3-10-19-17;18-17(19,20)12-4-6-14(7-5-12)27(25,26)23-10-8-13(11-23)22-16(24)15-3-1-2-9-21-15;21-17(16-8-4-5-10-18-16)19-15-9-11-20(12-15)24(22,23)13-14-6-2-1-3-7-14;1-12-2-4-14(5-3-12)23(20,21)18-8-6-13(11-18)10-15(19)16-17-7-9-22-16;16-13-4-2-1-3-11(13)10-24(21,22)19-7-5-12(9-19)18-14(20)15-17-6-8-23-15;18-13(14-15-7-9-21-14)16-11-6-8-17(10-11)22(19,20)12-4-2-1-3-5-12;/h2*2-12H,13H2,1H3,(H,20,22);1-11H,(H,22,24);1-12H,13H2,(H,19,21);2-9,11H,10H2,1H3;1-9H,10H2,(H,18,20);1-10H,(H,16,18);1H4
• InChIKey: KXXYYUVKXSAEFE-UHFFFAOYSA-N
• XLogP: 20.76
• TPSA: 555.39 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 38
• Rotatable Bonds: 33
• Heavy Atoms: 171
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2525.33
LogP ≤ 5	20.76
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	38

Frequently Asked Questions

What is the IUPAC name of N-[1-(benzenesulfonyl)pyrrol-3-yl]-1,3-thiazole-2-carboxamide;N-(1-benzylsulfonylpyrrol-3-yl)pyridine-2-carboxamide;N-[1-[(2-chlorophenyl)methylsulfonyl]pyrrol-3-yl]-1,3-thiazole-2-carboxamide;methane;N-[1-[(3-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;2-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]-1-(1,3-thiazol-2-yl)ethanone;N-[1-[4-(trifluoromethyl)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide?

The IUPAC name of N-[1-(benzenesulfonyl)pyrrol-3-yl]-1,3-thiazole-2-carboxamide;N-(1-benzylsulfonylpyrrol-3-yl)pyridine-2-carboxamide;N-[1-[(2-chlorophenyl)methylsulfonyl]pyrrol-3-yl]-1,3-thiazole-2-carboxamide;methane;N-[1-[(3-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;2-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]-1-(1,3-thiazol-2-yl)ethanone;N-[1-[4-(trifluoromethyl)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide (CID 159272917) is N-[1-(benzenesulfonyl)pyrrol-3-yl]-1,3-thiazole-2-carboxamide;N-(1-benzylsulfonylpyrrol-3-yl)pyridine-2-carboxamide;N-[1-[(2-chlorophenyl)methylsulfonyl]pyrrol-3-yl]-1,3-thiazole-2-carboxamide;methane;N-[1-[(3-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;2-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]-1-(1,3-thiazol-2-yl)ethanone;N-[1-[4-(trifluoromethyl)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide.

What is the SMILES notation for N-[1-(benzenesulfonyl)pyrrol-3-yl]-1,3-thiazole-2-carboxamide;N-(1-benzylsulfonylpyrrol-3-yl)pyridine-2-carboxamide;N-[1-[(2-chlorophenyl)methylsulfonyl]pyrrol-3-yl]-1,3-thiazole-2-carboxamide;methane;N-[1-[(3-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;2-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]-1-(1,3-thiazol-2-yl)ethanone;N-[1-[4-(trifluoromethyl)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide?

The canonical SMILES for N-[1-(benzenesulfonyl)pyrrol-3-yl]-1,3-thiazole-2-carboxamide;N-(1-benzylsulfonylpyrrol-3-yl)pyridine-2-carboxamide;N-[1-[(2-chlorophenyl)methylsulfonyl]pyrrol-3-yl]-1,3-thiazole-2-carboxamide;methane;N-[1-[(3-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;2-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]-1-(1,3-thiazol-2-yl)ethanone;N-[1-[4-(trifluoromethyl)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide is C.Cc1ccc(CS(=O)(=O)n2ccc(NC(=O)c3ccccn3)c2)cc1.Cc1ccc(S(=O)(=O)n2ccc(CC(=O)c3nccs3)c2)cc1.Cc1cccc(CS(=O)(=O)n2ccc(NC(=O)c3ccccn3)c2)c1.O=C(Nc1ccn(S(=O)(=O)Cc2ccccc2)c1)c1ccccn1.O=C(Nc1ccn(S(=O)(=O)Cc2ccccc2Cl)c1)c1nccs1.O=C(Nc1ccn(S(=O)(=O)c2ccc(C(F)(F)F)cc2)c1)c1ccccn1.O=C(Nc1ccn(S(=O)(=O)c2ccccc2)c1)c1nccs1.

What is the InChIKey of N-[1-(benzenesulfonyl)pyrrol-3-yl]-1,3-thiazole-2-carboxamide;N-(1-benzylsulfonylpyrrol-3-yl)pyridine-2-carboxamide;N-[1-[(2-chlorophenyl)methylsulfonyl]pyrrol-3-yl]-1,3-thiazole-2-carboxamide;methane;N-[1-[(3-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;2-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]-1-(1,3-thiazol-2-yl)ethanone;N-[1-[4-(trifluoromethyl)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide?

The InChIKey is KXXYYUVKXSAEFE-UHFFFAOYSA-N. The full InChI is InChI=1S/2C18H17N3O3S.C17H12F3N3O3S.C17H15N3O3S.C16H14N2O3S2.C15H12ClN3O3S2.C14H11N3O3S2.CH4/c1-14-5-4-6-15(11-14)13-25(23,24)21-10-8-16(12-21)20-18(22)17-7-2-3-9-19-17;1-14-5-7-15(8-6-14)13-25(23,24)21-11-9-16(12-21)20-18(22)17-4-2-3-10-19-17;18-17(19,20)12-4-6-14(7-5-12)27(25,26)23-10-8-13(11-23)22-16(24)15-3-1-2-9-21-15;21-17(16-8-4-5-10-18-16)19-15-9-11-20(12-15)24(22,23)13-14-6-2-1-3-7-14;1-12-2-4-14(5-3-12)23(20,21)18-8-6-13(11-18)10-15(19)16-17-7-9-22-16;16-13-4-2-1-3-11(13)10-24(21,22)19-7-5-12(9-19)18-14(20)15-17-6-8-23-15;18-13(14-15-7-9-21-14)16-11-6-8-17(10-11)22(19,20)12-4-2-1-3-5-12;/h2*2-12H,13H2,1H3,(H,20,22);1-11H,(H,22,24);1-12H,13H2,(H,19,21);2-9,11H,10H2,1H3;1-9H,10H2,(H,18,20);1-10H,(H,16,18);1H4.

What are the key properties of N-[1-(benzenesulfonyl)pyrrol-3-yl]-1,3-thiazole-2-carboxamide;N-(1-benzylsulfonylpyrrol-3-yl)pyridine-2-carboxamide;N-[1-[(2-chlorophenyl)methylsulfonyl]pyrrol-3-yl]-1,3-thiazole-2-carboxamide;methane;N-[1-[(3-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;2-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]-1-(1,3-thiazol-2-yl)ethanone;N-[1-[4-(trifluoromethyl)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide?

N-[1-(benzenesulfonyl)pyrrol-3-yl]-1,3-thiazole-2-carboxamide;N-(1-benzylsulfonylpyrrol-3-yl)pyridine-2-carboxamide;N-[1-[(2-chlorophenyl)methylsulfonyl]pyrrol-3-yl]-1,3-thiazole-2-carboxamide;methane;N-[1-[(3-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;2-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]-1-(1,3-thiazol-2-yl)ethanone;N-[1-[4-(trifluoromethyl)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide has a molecular weight of 2525.33 g/mol, XLogP of 20.76, 33 rotatable bonds, 6 hydrogen bond donors, and 38 hydrogen bond acceptors.

Where does this data come from?

All data for N-[1-(benzenesulfonyl)pyrrol-3-yl]-1,3-thiazole-2-carboxamide;N-(1-benzylsulfonylpyrrol-3-yl)pyridine-2-carboxamide;N-[1-[(2-chlorophenyl)methylsulfonyl]pyrrol-3-yl]-1,3-thiazole-2-carboxamide;methane;N-[1-[(3-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;N-[1-[(4-methylphenyl)methylsulfonyl]pyrrol-3-yl]pyridine-2-carboxamide;2-[1-(4-methylphenyl)sulfonylpyrrol-3-yl]-1-(1,3-thiazol-2-yl)ethanone;N-[1-[4-(trifluoromethyl)phenyl]sulfonylpyrrol-3-yl]pyridine-2-carboxamide is sourced from PubChem (CID 159272917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).