(E)-N-[4-(1H-benzimidazol-2-ylsulfanyl)phenyl]-3-(3-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-[4-(1H-benzimidazol-2-ylsulfanyl)phenyl]-3-(3-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-[4-(1H-benzimidazol-2-ylsulfanyl)phenyl]-3-(3-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[4-(1H-benzimidazol-2-ylthio)phenyl]-3-(3-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-[4-(1H-benzimidazol-2-ylsulfanyl)phenyl]-3-(3-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-[4-(1H-benzimidazol-2-ylthio)phenyl]-3-(3-nitrophenyl)acrylamide Formula: C22H16N4O3S MolecularWeight: 416.45244

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)SC3=CC=C(C=C3)NC(=O)C=CC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)SC3=CC=C(C=C3)NC(=O)/C=C/C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H16N4O3S/c27-21(13-8-15-4-3-5-17(14-15)26(28)29)23-16-9-11-18(12-10-16)30-22-24-19-6-1-2-7-20(19)25-22/h1-14H,(H,23,27)(H,24,25)/b13-8+