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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=CC=C(C=C2)Cl)C(=O)NN=CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CSC2=CC=C(C=C2)Cl)C(=O)N/N=C/C3=CC=C(C=C3)[N+](=O)[O-]

InChI

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