N-(2-methoxy-4-nitro-phenyl)-2-[(1-phenyl-4,5,6,7-tetrahydrobenzimidazol-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(2-methoxy-4-nitro-phenyl)-2-[(1-phenyl-4,5,6,7-tetrahydrobenzimidazol-2-yl)sulfanyl]ethanamide Openeye Name: N-(2-methoxy-4-nitro-phenyl)-2-[(1-phenyl-4,5,6,7-tetrahydrobenzimidazol-2-yl)sulfanyl]acetamide CAS Name: N-(2-methoxy-4-nitrophenyl)-2-[(1-phenyl-4,5,6,7-tetrahydrobenzimidazol-2-yl)thio]acetamide IUPAC Name: N-(2-methoxy-4-nitrophenyl)-2-[(1-phenyl-4,5,6,7-tetrahydrobenzimidazol-2-yl)sulfanyl]acetamide Traditional Name: N-(2-methoxy-4-nitro-phenyl)-2-[(1-phenyl-4,5,6,7-tetrahydrobenzimidazol-2-yl)thio]acetamide Formula: C22H22N4O4S MolecularWeight: 438.49948

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CSC2=NC3=C(N2C4=CC=CC=C4)CCCC3

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CSC2=NC3=C(N2C4=CC=CC=C4)CCCC3

InChI

InChI=1S/C22H22N4O4S/c1-30-20-13-16(26(28)29)11-12-18(20)23-21(27)14-31-22-24-17-9-5-6-10-19(17)25(22)15-7-3-2-4-8-15/h2-4,7-8,11-13H,5-6,9-10,14H2,1H3,(H,23,27)