4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[(2-nitrophenyl)methylideneamino]benzamide

Systemtic Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[(2-nitrophenyl)methylideneamino]benzamide Openeye Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[(2-nitrophenyl)methyleneamino]benzamide CAS Name: 4-[(1H-benzimidazol-2-ylthio)methyl]-N-[(2-nitrophenyl)methylideneamino]benzamide IUPAC Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[(2-nitrophenyl)methylideneamino]benzamide Traditional Name: 4-[(1H-benzimidazol-2-ylthio)methyl]-N-[(2-nitrobenzylidene)amino]benzamide Formula: C22H17N5O3S MolecularWeight: 431.46708

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=NNC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4N3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C=NNC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4N3)[N+](=O)[O-]

InChI

InChI=1S/C22H17N5O3S/c28-21(26-23-13-17-5-1-4-8-20(17)27(29)30)16-11-9-15(10-12-16)14-31-22-24-18-6-2-3-7-19(18)25-22/h1-13H,14H2,(H,24,25)(H,26,28)