N-(4-chlorophenyl)-4-(4-methylphenyl)sulfanyl-3-nitro-benzamide

Systemtic Name: N-(4-chlorophenyl)-4-(4-methylphenyl)sulfanyl-3-nitro-benzamide Openeye Name: N-(4-chlorophenyl)-3-nitro-4-(p-tolylsulfanyl)benzamide CAS Name: N-(4-chlorophenyl)-4-[(4-methylphenyl)thio]-3-nitrobenzamide IUPAC Name: N-(4-chlorophenyl)-4-(4-methylphenyl)sulfanyl-3-nitrobenzamide Traditional Name: N-(4-chlorophenyl)-3-nitro-4-(p-tolylthio)benzamide Formula: C20H15ClN2O3S MolecularWeight: 398.8627

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H15ClN2O3S/c1-13-2-9-17(10-3-13)27-19-11-4-14(12-18(19)23(25)26)20(24)22-16-7-5-15(21)6-8-16/h2-12H,1H3,(H,22,24)