2-(3-methyl-2-oxidanylidene-benzimidazol-1-yl)-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]ethanamide

Systemtic Name: 2-(3-methyl-2-oxidanylidene-benzimidazol-1-yl)-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]ethanamide Openeye Name: 2-(3-methyl-2-oxo-benzimidazol-1-yl)-N-[2-(4-methylsulfonyl-2-nitro-anilino)ethyl]acetamide CAS Name: 2-(3-methyl-2-oxo-1-benzimidazolyl)-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]acetamide IUPAC Name: 2-(3-methyl-2-oxobenzimidazol-1-yl)-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]acetamide Traditional Name: 2-(2-keto-3-methyl-benzimidazol-1-yl)-N-[2-(4-mesyl-2-nitro-anilino)ethyl]acetamide Formula: C19H21N5O6S MolecularWeight: 447.46494

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C1=O)CC(=O)NCCNC3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CN1C2=CC=CC=C2N(C1=O)CC(=O)NCCNC3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C19H21N5O6S/c1-22-15-5-3-4-6-16(15)23(19(22)26)12-18(25)21-10-9-20-14-8-7-13(31(2,29)30)11-17(14)24(27)28/h3-8,11,20H,9-10,12H2,1-2H3,(H,21,25)