2-[(3-cyano-7,7-dimethyl-5-oxidanylidene-6,8-dihydroquinolin-2-yl)sulfanyl]-N-(3-ethoxyphenyl)ethanamide

Systemtic Name: 2-[(3-cyano-7,7-dimethyl-5-oxidanylidene-6,8-dihydroquinolin-2-yl)sulfanyl]-N-(3-ethoxyphenyl)ethanamide Openeye Name: 2-[(3-cyano-7,7-dimethyl-5-oxo-6,8-dihydroquinolin-2-yl)sulfanyl]-N-(3-ethoxyphenyl)acetamide CAS Name: 2-[(3-cyano-7,7-dimethyl-5-oxo-6,8-dihydroquinolin-2-yl)thio]-N-(3-ethoxyphenyl)acetamide IUPAC Name: 2-[(3-cyano-7,7-dimethyl-5-oxo-6,8-dihydroquinolin-2-yl)sulfanyl]-N-(3-ethoxyphenyl)acetamide Traditional Name: 2-[(3-cyano-5-keto-7,7-dimethyl-6,8-dihydroquinolin-2-yl)thio]-N-m-phenetyl-acetamide Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)NC(=O)CSC2=NC3=C(C=C2C#N)C(=O)CC(C3)(C)C

Isomeric SMILES

CCOC1=CC=CC(=C1)NC(=O)CSC2=NC3=C(C=C2C#N)C(=O)CC(C3)(C)C

InChI

InChI=1S/C22H23N3O3S/c1-4-28-16-7-5-6-15(9-16)24-20(27)13-29-21-14(12-23)8-17-18(25-21)10-22(2,3)11-19(17)26/h5-9H,4,10-11,13H2,1-3H3,(H,24,27)