2-(3-cyano-6-methyl-quinolin-2-yl)sulfanyl-N-(2,4,6-trimethylphenyl)ethanamide

Systemtic Name: 2-(3-cyano-6-methyl-quinolin-2-yl)sulfanyl-N-(2,4,6-trimethylphenyl)ethanamide Openeye Name: 2-[(3-cyano-6-methyl-2-quinolyl)sulfanyl]-N-(2,4,6-trimethylphenyl)acetamide CAS Name: 2-[(3-cyano-6-methyl-2-quinolinyl)thio]-N-(2,4,6-trimethylphenyl)acetamide IUPAC Name: 2-(3-cyano-6-methylquinolin-2-yl)sulfanyl-N-(2,4,6-trimethylphenyl)acetamide Traditional Name: 2-[(3-cyano-6-methyl-2-quinolyl)thio]-N-mesityl-acetamide Formula: C22H21N3OS MolecularWeight: 375.48664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)NC3=C(C=C(C=C3C)C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)NC3=C(C=C(C=C3C)C)C

InChI

InChI=1S/C22H21N3OS/c1-13-5-6-19-17(9-13)10-18(11-23)22(24-19)27-12-20(26)25-21-15(3)7-14(2)8-16(21)4/h5-10H,12H2,1-4H3,(H,25,26)