N-[5-chloranyl-4-[(4-chlorophenyl)-cyano-methyl]-2-methyl-phenyl]-2-propan-2-ylsulfanyl-benzamide

Systemtic Name: N-[5-chloranyl-4-[(4-chlorophenyl)-cyano-methyl]-2-methyl-phenyl]-2-propan-2-ylsulfanyl-benzamide Openeye Name: N-[5-chloro-4-[(4-chlorophenyl)-cyano-methyl]-2-methyl-phenyl]-2-isopropylsulfanyl-benzamide CAS Name: N-[5-chloro-4-[(4-chlorophenyl)-cyanomethyl]-2-methylphenyl]-2-(propan-2-ylthio)benzamide IUPAC Name: N-[5-chloro-4-[(4-chlorophenyl)-cyanomethyl]-2-methylphenyl]-2-propan-2-ylsulfanylbenzamide Traditional Name: N-[5-chloro-4-[(4-chlorophenyl)-cyano-methyl]-2-methyl-phenyl]-2-(isopropylthio)benzamide Formula: C25H22Cl2N2OS MolecularWeight: 469.42598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2SC(C)C)Cl)C(C#N)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2SC(C)C)Cl)C(C#N)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C25H22Cl2N2OS/c1-15(2)31-24-7-5-4-6-19(24)25(30)29-23-13-22(27)20(12-16(23)3)21(14-28)17-8-10-18(26)11-9-17/h4-13,15,21H,1-3H3,(H,29,30)