2,6-bis(chloranyl)-N-[[3-(4-methylphenyl)-2-sulfanyl-phenyl]carbamoyl]benzamide

Systemtic Name: 2,6-bis(chloranyl)-N-[[3-(4-methylphenyl)-2-sulfanyl-phenyl]carbamoyl]benzamide Openeye Name: 2,6-dichloro-N-[[3-(p-tolyl)-2-sulfanyl-phenyl]carbamoyl]benzamide CAS Name: 2,6-dichloro-N-[[2-mercapto-3-(4-methylphenyl)anilino]-oxomethyl]benzamide IUPAC Name: 2,6-dichloro-N-[[3-(4-methylphenyl)-2-sulfanylphenyl]carbamoyl]benzamide Traditional Name: 2,6-dichloro-N-[[2-mercapto-3-(p-tolyl)phenyl]carbamoyl]benzamide Formula: C21H16Cl2N2O2S MolecularWeight: 431.33494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=CC=C2)NC(=O)NC(=O)C3=C(C=CC=C3Cl)Cl)S

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=CC=C2)NC(=O)NC(=O)C3=C(C=CC=C3Cl)Cl)S

InChI

InChI=1S/C21H16Cl2N2O2S/c1-12-8-10-13(11-9-12)14-4-2-7-17(19(14)28)24-21(27)25-20(26)18-15(22)5-3-6-16(18)23/h2-11,28H,1H3,(H2,24,25,26,27)