3-[(3-cyano-4-ethyl-7,7-dimethyl-5-oxidanylidene-6,8-dihydroquinolin-2-yl)sulfanyl]-N-(3-methoxyphenyl)propanamide

Systemtic Name: 3-[(3-cyano-4-ethyl-7,7-dimethyl-5-oxidanylidene-6,8-dihydroquinolin-2-yl)sulfanyl]-N-(3-methoxyphenyl)propanamide Openeye Name: 3-[(3-cyano-4-ethyl-7,7-dimethyl-5-oxo-6,8-dihydroquinolin-2-yl)sulfanyl]-N-(3-methoxyphenyl)propanamide CAS Name: 3-[(3-cyano-4-ethyl-7,7-dimethyl-5-oxo-6,8-dihydroquinolin-2-yl)thio]-N-(3-methoxyphenyl)propanamide IUPAC Name: 3-[(3-cyano-4-ethyl-7,7-dimethyl-5-oxo-6,8-dihydroquinolin-2-yl)sulfanyl]-N-(3-methoxyphenyl)propanamide Traditional Name: 3-[(3-cyano-4-ethyl-5-keto-7,7-dimethyl-6,8-dihydroquinolin-2-yl)thio]-N-(3-methoxyphenyl)propionamide Formula: C24H27N3O3S MolecularWeight: 437.55448

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC2=C1C(=O)CC(C2)(C)C)SCCC(=O)NC3=CC(=CC=C3)OC)C#N

Isomeric SMILES

CCC1=C(C(=NC2=C1C(=O)CC(C2)(C)C)SCCC(=O)NC3=CC(=CC=C3)OC)C#N

InChI

InChI=1S/C24H27N3O3S/c1-5-17-18(14-25)23(27-19-12-24(2,3)13-20(28)22(17)19)31-10-9-21(29)26-15-7-6-8-16(11-15)30-4/h6-8,11H,5,9-10,12-13H2,1-4H3,(H,26,29)