2-(1H-benzimidazol-2-ylsulfanyl)-N-[4-(pyridin-3-ylmethylsulfamoyl)phenyl]ethanamide

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[4-(pyridin-3-ylmethylsulfamoyl)phenyl]ethanamide Openeye Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[4-(3-pyridylmethylsulfamoyl)phenyl]acetamide CAS Name: 2-(1H-benzimidazol-2-ylthio)-N-[4-(3-pyridinylmethylsulfamoyl)phenyl]acetamide IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[4-(pyridin-3-ylmethylsulfamoyl)phenyl]acetamide Traditional Name: 2-(1H-benzimidazol-2-ylthio)-N-[4-(3-pyridylmethylsulfamoyl)phenyl]acetamide Formula: C21H19N5O3S2 MolecularWeight: 453.53726

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)SCC(=O)NC3=CC=C(C=C3)S(=O)(=O)NCC4=CN=CC=C4

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)SCC(=O)NC3=CC=C(C=C3)S(=O)(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C21H19N5O3S2/c27-20(14-30-21-25-18-5-1-2-6-19(18)26-21)24-16-7-9-17(10-8-16)31(28,29)23-13-15-4-3-11-22-12-15/h1-12,23H,13-14H2,(H,24,27)(H,25,26)