4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[(E)-[4-(4-methoxyphenoxy)-3-nitro-phenyl]methylideneamino]benzamide

Systemtic Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[(E)-[4-(4-methoxyphenoxy)-3-nitro-phenyl]methylideneamino]benzamide Openeye Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[(E)-[4-(4-methoxyphenoxy)-3-nitro-phenyl]methyleneamino]benzamide CAS Name: 4-[(1H-benzimidazol-2-ylthio)methyl]-N-[(E)-[4-(4-methoxyphenoxy)-3-nitrophenyl]methylideneamino]benzamide IUPAC Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[(E)-[4-(4-methoxyphenoxy)-3-nitrophenyl]methylideneamino]benzamide Traditional Name: 4-[(1H-benzimidazol-2-ylthio)methyl]-N-[(E)-[4-(4-methoxyphenoxy)-3-nitro-benzylidene]amino]benzamide Formula: C29H23N5O5S MolecularWeight: 553.58842

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OC2=C(C=C(C=C2)C=NNC(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5N4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)OC2=C(C=C(C=C2)/C=N/NC(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5N4)[N+](=O)[O-]

InChI

InChI=1S/C29H23N5O5S/c1-38-22-11-13-23(14-12-22)39-27-15-8-20(16-26(27)34(36)37)17-30-33-28(35)21-9-6-19(7-10-21)18-40-29-31-24-4-2-3-5-25(24)32-29/h2-17H,18H2,1H3,(H,31,32)(H,33,35)/b30-17+