4-[(4-chlorophenyl)-methylsulfonyl-amino]-N-(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)butanamide

Systemtic Name: 4-[(4-chlorophenyl)-methylsulfonyl-amino]-N-(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)butanamide Openeye Name: 4-(4-chloro-N-methylsulfonyl-anilino)-N-(1,3-dimethyl-2-oxo-benzimidazol-5-yl)butanamide CAS Name: 4-(4-chloro-N-methylsulfonylanilino)-N-(1,3-dimethyl-2-oxo-5-benzimidazolyl)butanamide IUPAC Name: 4-(4-chloro-N-methylsulfonylanilino)-N-(1,3-dimethyl-2-oxobenzimidazol-5-yl)butanamide Traditional Name: 4-(4-chloro-N-mesyl-anilino)-N-(2-keto-1,3-dimethyl-benzimidazol-5-yl)butyramide Formula: C20H23ClN4O4S MolecularWeight: 450.93902

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NC(=O)CCCN(C3=CC=C(C=C3)Cl)S(=O)(=O)C)N(C1=O)C

Isomeric SMILES

CN1C2=C(C=C(C=C2)NC(=O)CCCN(C3=CC=C(C=C3)Cl)S(=O)(=O)C)N(C1=O)C

InChI

InChI=1S/C20H23ClN4O4S/c1-23-17-11-8-15(13-18(17)24(2)20(23)27)22-19(26)5-4-12-25(30(3,28)29)16-9-6-14(21)7-10-16/h6-11,13H,4-5,12H2,1-3H3,(H,22,26)