3-[(6-tert-butyl-3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(5-chloranyl-2-methoxy-phenyl)propanamide

Systemtic Name: 3-[(6-tert-butyl-3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(5-chloranyl-2-methoxy-phenyl)propanamide Openeye Name: 3-[(6-tert-butyl-3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(5-chloro-2-methoxy-phenyl)propanamide CAS Name: 3-[(6-tert-butyl-3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)thio]-N-(5-chloro-2-methoxyphenyl)propanamide IUPAC Name: 3-[(6-tert-butyl-3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-(5-chloro-2-methoxyphenyl)propanamide Traditional Name: 3-[(6-tert-butyl-3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)thio]-N-(5-chloro-2-methoxy-phenyl)propionamide Formula: C24H28ClN3O2S MolecularWeight: 458.01602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)C=C(C(=N2)SCCC(=O)NC3=C(C=CC(=C3)Cl)OC)C#N

Isomeric SMILES

CC(C)(C)C1CCC2=C(C1)C=C(C(=N2)SCCC(=O)NC3=C(C=CC(=C3)Cl)OC)C#N

InChI

InChI=1S/C24H28ClN3O2S/c1-24(2,3)17-5-7-19-15(12-17)11-16(14-26)23(28-19)31-10-9-22(29)27-20-13-18(25)6-8-21(20)30-4/h6,8,11,13,17H,5,7,9-10,12H2,1-4H3,(H,27,29)