2-[[1-(3-chlorophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-(2-cyanopropan-2-yl)-N-methyl-ethanamide

Systemtic Name: 2-[[1-(3-chlorophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-(2-cyanopropan-2-yl)-N-methyl-ethanamide Openeye Name: 2-[1-(3-chlorophenyl)tetrazol-5-yl]sulfanyl-N-(1-cyano-1-methyl-ethyl)-N-methyl-acetamide CAS Name: 2-[[1-(3-chlorophenyl)-5-tetrazolyl]thio]-N-(2-cyanopropan-2-yl)-N-methylacetamide IUPAC Name: 2-[1-(3-chlorophenyl)tetrazol-5-yl]sulfanyl-N-(2-cyanopropan-2-yl)-N-methylacetamide Traditional Name: 2-[[1-(3-chlorophenyl)tetrazol-5-yl]thio]-N-(1-cyano-1-methyl-ethyl)-N-methyl-acetamide Formula: C14H15ClN6OS MolecularWeight: 350.8265

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)N(C)C(=O)CSC1=NN=NN1C2=CC(=CC=C2)Cl

Isomeric SMILES

CC(C)(C#N)N(C)C(=O)CSC1=NN=NN1C2=CC(=CC=C2)Cl

InChI

InChI=1S/C14H15ClN6OS/c1-14(2,9-16)20(3)12(22)8-23-13-17-18-19-21(13)11-6-4-5-10(15)7-11/h4-7H,8H2,1-3H3