N-[(E)-1-(3-nitrophenyl)ethylideneamino]-2-[1-(phenylmethyl)benzimidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[(E)-1-(3-nitrophenyl)ethylideneamino]-2-[1-(phenylmethyl)benzimidazol-2-yl]sulfanyl-ethanamide Openeye Name: 2-(1-benzylbenzimidazol-2-yl)sulfanyl-N-[(E)-1-(3-nitrophenyl)ethylideneamino]acetamide CAS Name: N-[(E)-1-(3-nitrophenyl)ethylideneamino]-2-[[1-(phenylmethyl)-2-benzimidazolyl]thio]acetamide IUPAC Name: 2-(1-benzylbenzimidazol-2-yl)sulfanyl-N-[(E)-1-(3-nitrophenyl)ethylideneamino]acetamide Traditional Name: 2-[(1-benzylbenzimidazol-2-yl)thio]-N-[(E)-1-(3-nitrophenyl)ethylideneamino]acetamide Formula: C24H21N5O3S MolecularWeight: 459.52024

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)CSC1=NC2=CC=CC=C2N1CC3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C/C(=N\NC(=O)CSC1=NC2=CC=CC=C2N1CC3=CC=CC=C3)/C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H21N5O3S/c1-17(19-10-7-11-20(14-19)29(31)32)26-27-23(30)16-33-24-25-21-12-5-6-13-22(21)28(24)15-18-8-3-2-4-9-18/h2-14H,15-16H2,1H3,(H,27,30)/b26-17+