2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-N-(2-cyanoethyl)-N-methyl-ethanamide

Systemtic Name: 2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-N-(2-cyanoethyl)-N-methyl-ethanamide Openeye Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-N-(2-cyanoethyl)-N-methyl-acetamide CAS Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-N-(2-cyanoethyl)-N-methylacetamide IUPAC Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-N-(2-cyanoethyl)-N-methylacetamide Traditional Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-N-(2-cyanoethyl)-N-methyl-acetamide Formula: C13H12ClN3OS2 MolecularWeight: 325.83688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C(=O)CSC1=NC2=C(S1)C=CC(=C2)Cl

Isomeric SMILES

CN(CCC#N)C(=O)CSC1=NC2=C(S1)C=CC(=C2)Cl

InChI

InChI=1S/C13H12ClN3OS2/c1-17(6-2-5-15)12(18)8-19-13-16-10-7-9(14)3-4-11(10)20-13/h3-4,7H,2,6,8H2,1H3