(2R)-2-[1-(4-chlorophenyl)imidazol-2-yl]sulfanyl-N-(2-cyanoethyl)-N-methyl-propanamide

Systemtic Name: (2R)-2-[1-(4-chlorophenyl)imidazol-2-yl]sulfanyl-N-(2-cyanoethyl)-N-methyl-propanamide Openeye Name: (2R)-2-[1-(4-chlorophenyl)imidazol-2-yl]sulfanyl-N-(2-cyanoethyl)-N-methyl-propanamide CAS Name: (2R)-2-[[1-(4-chlorophenyl)-2-imidazolyl]thio]-N-(2-cyanoethyl)-N-methylpropanamide IUPAC Name: (2R)-2-[1-(4-chlorophenyl)imidazol-2-yl]sulfanyl-N-(2-cyanoethyl)-N-methylpropanamide Traditional Name: (2R)-2-[[1-(4-chlorophenyl)imidazol-2-yl]thio]-N-(2-cyanoethyl)-N-methyl-propionamide Formula: C16H17ClN4OS MolecularWeight: 348.85038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)CCC#N)SC1=NC=CN1C2=CC=C(C=C2)Cl

Isomeric SMILES

C[C@H](C(=O)N(C)CCC#N)SC1=NC=CN1C2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H17ClN4OS/c1-12(15(22)20(2)10-3-8-18)23-16-19-9-11-21(16)14-6-4-13(17)5-7-14/h4-7,9,11-12H,3,10H2,1-2H3/t12-/m1/s1