N-(2-cyanoethyl)-2-(4,8-dimethylquinolin-2-yl)sulfanyl-N-(2-methoxyphenyl)ethanamide

Systemtic Name: N-(2-cyanoethyl)-2-(4,8-dimethylquinolin-2-yl)sulfanyl-N-(2-methoxyphenyl)ethanamide Openeye Name: N-(2-cyanoethyl)-2-[(4,8-dimethyl-2-quinolyl)sulfanyl]-N-(2-methoxyphenyl)acetamide CAS Name: N-(2-cyanoethyl)-2-[(4,8-dimethyl-2-quinolinyl)thio]-N-(2-methoxyphenyl)acetamide IUPAC Name: N-(2-cyanoethyl)-2-(4,8-dimethylquinolin-2-yl)sulfanyl-N-(2-methoxyphenyl)acetamide Traditional Name: N-(2-cyanoethyl)-2-[(4,8-dimethyl-2-quinolyl)thio]-N-(2-methoxyphenyl)acetamide Formula: C23H23N3O2S MolecularWeight: 405.51262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)SCC(=O)N(CCC#N)C3=CC=CC=C3OC

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)SCC(=O)N(CCC#N)C3=CC=CC=C3OC

InChI

InChI=1S/C23H23N3O2S/c1-16-8-6-9-18-17(2)14-21(25-23(16)18)29-15-22(27)26(13-7-12-24)19-10-4-5-11-20(19)28-3/h4-6,8-11,14H,7,13,15H2,1-3H3