3-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(4-ethoxyphenyl)propanamide

Systemtic Name: 3-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(4-ethoxyphenyl)propanamide Openeye Name: 3-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(4-ethoxyphenyl)propanamide CAS Name: 3-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)thio]-N-(4-ethoxyphenyl)propanamide IUPAC Name: 3-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(4-ethoxyphenyl)propanamide Traditional Name: 3-[(3-cyano-6-methyl-5,6,7,8-tetrahydroquinolin-2-yl)thio]-N-p-phenetyl-propionamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CCSC2=NC3=C(CC(CC3)C)C=C2C#N

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CCSC2=NC3=C(CC(CC3)C)C=C2C#N

InChI

InChI=1S/C22H25N3O2S/c1-3-27-19-7-5-18(6-8-19)24-21(26)10-11-28-22-17(14-23)13-16-12-15(2)4-9-20(16)25-22/h5-8,13,15H,3-4,9-12H2,1-2H3,(H,24,26)