N-[4-(4-methylphenyl)sulfanylphenyl]-4-nitro-benzamide

Systemtic Name: N-[4-(4-methylphenyl)sulfanylphenyl]-4-nitro-benzamide Openeye Name: 4-nitro-N-[4-(p-tolylsulfanyl)phenyl]benzamide CAS Name: N-[4-[(4-methylphenyl)thio]phenyl]-4-nitrobenzamide IUPAC Name: N-[4-(4-methylphenyl)sulfanylphenyl]-4-nitrobenzamide Traditional Name: 4-nitro-N-[4-(p-tolylthio)phenyl]benzamide Formula: C20H16N2O3S MolecularWeight: 364.41764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)SC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H16N2O3S/c1-14-2-10-18(11-3-14)26-19-12-6-16(7-13-19)21-20(23)15-4-8-17(9-5-15)22(24)25/h2-13H,1H3,(H,21,23)