2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]-N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)ethanamide

Systemtic Name: 2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]-N-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)ethanamide Openeye Name: 2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide CAS Name: 2-[(4-methoxy-3-nitrophenyl)methylthio]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide IUPAC Name: 2-[(4-methoxy-3-nitrophenyl)methylsulfanyl]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide Traditional Name: N-(2-keto-1,3-dihydrobenzimidazol-5-yl)-2-[(4-methoxy-3-nitro-benzyl)thio]acetamide Formula: C17H16N4O5S MolecularWeight: 388.39774

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CSCC(=O)NC2=CC3=C(C=C2)NC(=O)N3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)CSCC(=O)NC2=CC3=C(C=C2)NC(=O)N3)[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O5S/c1-26-15-5-2-10(6-14(15)21(24)25)8-27-9-16(22)18-11-3-4-12-13(7-11)20-17(23)19-12/h2-7H,8-9H2,1H3,(H,18,22)(H2,19,20,23)