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

Systemtic Name: 3-[(3-cyano-7,7-dimethyl-5-oxidanylidene-4-phenyl-6,8-dihydroquinolin-2-yl)sulfanyl]-N-(4-fluorophenyl)propanamide Openeye Name: 3-[(3-cyano-7,7-dimethyl-5-oxo-4-phenyl-6,8-dihydroquinolin-2-yl)sulfanyl]-N-(4-fluorophenyl)propanamide CAS Name: 3-[(3-cyano-7,7-dimethyl-5-oxo-4-phenyl-6,8-dihydroquinolin-2-yl)thio]-N-(4-fluorophenyl)propanamide IUPAC Name: 3-[(3-cyano-7,7-dimethyl-5-oxo-4-phenyl-6,8-dihydroquinolin-2-yl)sulfanyl]-N-(4-fluorophenyl)propanamide Traditional Name: 3-[(3-cyano-5-keto-7,7-dimethyl-4-phenyl-6,8-dihydroquinolin-2-yl)thio]-N-(4-fluorophenyl)propionamide Formula: C27H24FN3O2S MolecularWeight: 473.561763

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=O)C1)C(=C(C(=N2)SCCC(=O)NC3=CC=C(C=C3)F)C#N)C4=CC=CC=C4)C

Isomeric SMILES

CC1(CC2=C(C(=O)C1)C(=C(C(=N2)SCCC(=O)NC3=CC=C(C=C3)F)C#N)C4=CC=CC=C4)C

InChI

InChI=1S/C27H24FN3O2S/c1-27(2)14-21-25(22(32)15-27)24(17-6-4-3-5-7-17)20(16-29)26(31-21)34-13-12-23(33)30-19-10-8-18(28)9-11-19/h3-11H,12-15H2,1-2H3,(H,30,33)