4-(1H-benzimidazol-2-ylsulfanyl)-N-[4-(4-nitrophenyl)sulfonylphenyl]butanamide

Systemtic Name: 4-(1H-benzimidazol-2-ylsulfanyl)-N-[4-(4-nitrophenyl)sulfonylphenyl]butanamide Openeye Name: 4-(1H-benzimidazol-2-ylsulfanyl)-N-[4-(4-nitrophenyl)sulfonylphenyl]butanamide CAS Name: 4-(1H-benzimidazol-2-ylthio)-N-[4-(4-nitrophenyl)sulfonylphenyl]butanamide IUPAC Name: 4-(1H-benzimidazol-2-ylsulfanyl)-N-[4-(4-nitrophenyl)sulfonylphenyl]butanamide Traditional Name: 4-(1H-benzimidazol-2-ylthio)-N-(4-nosylphenyl)butyramide Formula: C23H20N4O5S2 MolecularWeight: 496.5587

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)SCCCC(=O)NC3=CC=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)SCCCC(=O)NC3=CC=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H20N4O5S2/c28-22(6-3-15-33-23-25-20-4-1-2-5-21(20)26-23)24-16-7-11-18(12-8-16)34(31,32)19-13-9-17(10-14-19)27(29)30/h1-2,4-5,7-14H,3,6,15H2,(H,24,28)(H,25,26)