2-(4-nitrophenyl)sulfanyl-3-(3,4,5-trimethoxyphenyl)-5H-pyrido[1,2-a]benzimidazol-1-one

Systemtic Name: 2-(4-nitrophenyl)sulfanyl-3-(3,4,5-trimethoxyphenyl)-5H-pyrido[1,2-a]benzimidazol-1-one Openeye Name: 2-(4-nitrophenyl)sulfanyl-3-(3,4,5-trimethoxyphenyl)-5H-pyrido[1,2-a]benzimidazol-1-one CAS Name: 2-[(4-nitrophenyl)thio]-3-(3,4,5-trimethoxyphenyl)-5H-pyrido[1,2-a]benzimidazol-1-one IUPAC Name: 2-(4-nitrophenyl)sulfanyl-3-(3,4,5-trimethoxyphenyl)-5H-pyrido[1,2-a]benzimidazol-1-one Traditional Name: 2-[(4-nitrophenyl)thio]-3-(3,4,5-trimethoxyphenyl)-5H-pyrido[1,2-a]benzimidazol-1-one Formula: C26H21N3O6S MolecularWeight: 503.52644

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=C(C(=O)N3C4=CC=CC=C4NC3=C2)SC5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=C(C(=O)N3C4=CC=CC=C4NC3=C2)SC5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C26H21N3O6S/c1-33-21-12-15(13-22(34-2)24(21)35-3)18-14-23-27-19-6-4-5-7-20(19)28(23)26(30)25(18)36-17-10-8-16(9-11-17)29(31)32/h4-14,27H,1-3H3