2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-N-(2-cyanoethyl)-N-(4-ethoxyphenyl)ethanamide

Systemtic Name: 2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-N-(2-cyanoethyl)-N-(4-ethoxyphenyl)ethanamide Openeye Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-N-(2-cyanoethyl)-N-(4-ethoxyphenyl)acetamide CAS Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-N-(2-cyanoethyl)-N-(4-ethoxyphenyl)acetamide IUPAC Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-N-(2-cyanoethyl)-N-(4-ethoxyphenyl)acetamide Traditional Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-N-(2-cyanoethyl)-N-p-phenetyl-acetamide Formula: C20H18ClN3O2S2 MolecularWeight: 431.95882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(CCC#N)C(=O)CSC2=NC3=C(S2)C=CC(=C3)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)N(CCC#N)C(=O)CSC2=NC3=C(S2)C=CC(=C3)Cl

InChI

InChI=1S/C20H18ClN3O2S2/c1-2-26-16-7-5-15(6-8-16)24(11-3-10-22)19(25)13-27-20-23-17-12-14(21)4-9-18(17)28-20/h4-9,12H,2-3,11,13H2,1H3