N-(3-chloranyl-4-methyl-phenyl)-2-(cyanomethylsulfanyl)benzamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-2-(cyanomethylsulfanyl)benzamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-2-(cyanomethylsulfanyl)benzamide CAS Name: N-(3-chloro-4-methylphenyl)-2-(cyanomethylthio)benzamide IUPAC Name: N-(3-chloro-4-methylphenyl)-2-(cyanomethylsulfanyl)benzamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-2-(cyanomethylthio)benzamide Formula: C16H13ClN2OS MolecularWeight: 316.80522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2SCC#N)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2SCC#N)Cl

InChI

InChI=1S/C16H13ClN2OS/c1-11-6-7-12(10-14(11)17)19-16(20)13-4-2-3-5-15(13)21-9-8-18/h2-7,10H,9H2,1H3,(H,19,20)