2-chloranyl-N-[2-[2-(4-methylphenyl)sulfanylethylcarbamoyl]phenyl]-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[2-[2-(4-methylphenyl)sulfanylethylcarbamoyl]phenyl]-4-nitro-benzamide Openeye Name: 2-chloro-4-nitro-N-[2-[2-(p-tolylsulfanyl)ethylcarbamoyl]phenyl]benzamide CAS Name: 2-chloro-N-[2-[[2-[(4-methylphenyl)thio]ethylamino]-oxomethyl]phenyl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-[2-[2-(4-methylphenyl)sulfanylethylcarbamoyl]phenyl]-4-nitrobenzamide Traditional Name: 2-chloro-4-nitro-N-[2-[2-(p-tolylthio)ethylcarbamoyl]phenyl]benzamide Formula: C23H20ClN3O4S MolecularWeight: 469.9406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)C2=CC=CC=C2NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)C2=CC=CC=C2NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C23H20ClN3O4S/c1-15-6-9-17(10-7-15)32-13-12-25-22(28)19-4-2-3-5-21(19)26-23(29)18-11-8-16(27(30)31)14-20(18)24/h2-11,14H,12-13H2,1H3,(H,25,28)(H,26,29)