3-acetamido-4-(4-chlorophenyl)sulfanyl-N-(2-cyanoethyl)-N-methyl-benzamide

Systemtic Name: 3-acetamido-4-(4-chlorophenyl)sulfanyl-N-(2-cyanoethyl)-N-methyl-benzamide Openeye Name: 3-acetamido-4-(4-chlorophenyl)sulfanyl-N-(2-cyanoethyl)-N-methyl-benzamide CAS Name: 3-acetamido-4-[(4-chlorophenyl)thio]-N-(2-cyanoethyl)-N-methylbenzamide IUPAC Name: 3-acetamido-4-(4-chlorophenyl)sulfanyl-N-(2-cyanoethyl)-N-methylbenzamide Traditional Name: 3-acetamido-4-[(4-chlorophenyl)thio]-N-(2-cyanoethyl)-N-methyl-benzamide Formula: C19H18ClN3O2S MolecularWeight: 387.88312

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)C(=O)N(C)CCC#N)SC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)C(=O)N(C)CCC#N)SC2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H18ClN3O2S/c1-13(24)22-17-12-14(19(25)23(2)11-3-10-21)4-9-18(17)26-16-7-5-15(20)6-8-16/h4-9,12H,3,11H2,1-2H3,(H,22,24)