4-(1H-benzimidazol-2-ylsulfanyl)-N-(4-methylsulfonylphenyl)butanamide

Systemtic Name: 4-(1H-benzimidazol-2-ylsulfanyl)-N-(4-methylsulfonylphenyl)butanamide Openeye Name: 4-(1H-benzimidazol-2-ylsulfanyl)-N-(4-methylsulfonylphenyl)butanamide CAS Name: 4-(1H-benzimidazol-2-ylthio)-N-(4-methylsulfonylphenyl)butanamide IUPAC Name: 4-(1H-benzimidazol-2-ylsulfanyl)-N-(4-methylsulfonylphenyl)butanamide Traditional Name: 4-(1H-benzimidazol-2-ylthio)-N-(4-mesylphenyl)butyramide Formula: C18H19N3O3S2 MolecularWeight: 389.49176

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)NC(=O)CCCSC2=NC3=CC=CC=C3N2

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)NC(=O)CCCSC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C18H19N3O3S2/c1-26(23,24)14-10-8-13(9-11-14)19-17(22)7-4-12-25-18-20-15-5-2-3-6-16(15)21-18/h2-3,5-6,8-11H,4,7,12H2,1H3,(H,19,22)(H,20,21)