4-[(4-chlorophenyl)sulfanylmethyl]-N-[(E)-(3-nitrophenyl)methylideneamino]benzamide

Systemtic Name: 4-[(4-chlorophenyl)sulfanylmethyl]-N-[(E)-(3-nitrophenyl)methylideneamino]benzamide Openeye Name: 4-[(4-chlorophenyl)sulfanylmethyl]-N-[(E)-(3-nitrophenyl)methyleneamino]benzamide CAS Name: 4-[[(4-chlorophenyl)thio]methyl]-N-[(E)-(3-nitrophenyl)methylideneamino]benzamide IUPAC Name: 4-[(4-chlorophenyl)sulfanylmethyl]-N-[(E)-(3-nitrophenyl)methylideneamino]benzamide Traditional Name: 4-[[(4-chlorophenyl)thio]methyl]-N-[(E)-(3-nitrobenzylidene)amino]benzamide Formula: C21H16ClN3O3S MolecularWeight: 425.88804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C=NNC(=O)C2=CC=C(C=C2)CSC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])/C=N/NC(=O)C2=CC=C(C=C2)CSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H16ClN3O3S/c22-18-8-10-20(11-9-18)29-14-15-4-6-17(7-5-15)21(26)24-23-13-16-2-1-3-19(12-16)25(27)28/h1-13H,14H2,(H,24,26)/b23-13+