2-[(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)sulfonyl-ethyl-amino]-N-(4-nitrophenyl)ethanamide

Systemtic Name: 2-[(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)sulfonyl-ethyl-amino]-N-(4-nitrophenyl)ethanamide Openeye Name: 2-[(1,3-dimethyl-2-oxo-benzimidazol-5-yl)sulfonyl-ethyl-amino]-N-(4-nitrophenyl)acetamide CAS Name: 2-[(1,3-dimethyl-2-oxo-5-benzimidazolyl)sulfonyl-ethylamino]-N-(4-nitrophenyl)acetamide IUPAC Name: 2-[(1,3-dimethyl-2-oxobenzimidazol-5-yl)sulfonyl-ethylamino]-N-(4-nitrophenyl)acetamide Traditional Name: 2-[ethyl-(2-keto-1,3-dimethyl-benzimidazol-5-yl)sulfonyl-amino]-N-(4-nitrophenyl)acetamide Formula: C19H21N5O6S MolecularWeight: 447.46494

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC1=CC=C(C=C1)[N+](=O)[O-])S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)N3C)C

Isomeric SMILES

CCN(CC(=O)NC1=CC=C(C=C1)[N+](=O)[O-])S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)N3C)C

InChI

InChI=1S/C19H21N5O6S/c1-4-23(12-18(25)20-13-5-7-14(8-6-13)24(27)28)31(29,30)15-9-10-16-17(11-15)22(3)19(26)21(16)2/h5-11H,4,12H2,1-3H3,(H,20,25)