2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(3,5-dimethoxyphenyl)propanamide

Systemtic Name: 2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(3,5-dimethoxyphenyl)propanamide Openeye Name: 2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(3,5-dimethoxyphenyl)propanamide CAS Name: 2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)thio]-N-(3,5-dimethoxyphenyl)propanamide IUPAC Name: 2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(3,5-dimethoxyphenyl)propanamide Traditional Name: 2-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)thio]-N-(3,5-dimethoxyphenyl)propionamide Formula: C22H25N3O3S MolecularWeight: 411.5172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(C(=N2)SC(C)C(=O)NC3=CC(=CC(=C3)OC)OC)C#N

Isomeric SMILES

CC1CCC2=C(C1)C=C(C(=N2)SC(C)C(=O)NC3=CC(=CC(=C3)OC)OC)C#N

InChI

InChI=1S/C22H25N3O3S/c1-13-5-6-20-15(7-13)8-16(12-23)22(25-20)29-14(2)21(26)24-17-9-18(27-3)11-19(10-17)28-4/h8-11,13-14H,5-7H2,1-4H3,(H,24,26)