2-(3-cyano-6,7-dimethoxy-quinolin-2-yl)sulfanyl-N-(4-ethylphenyl)ethanamide

Systemtic Name: 2-(3-cyano-6,7-dimethoxy-quinolin-2-yl)sulfanyl-N-(4-ethylphenyl)ethanamide Openeye Name: 2-[(3-cyano-6,7-dimethoxy-2-quinolyl)sulfanyl]-N-(4-ethylphenyl)acetamide CAS Name: 2-[(3-cyano-6,7-dimethoxy-2-quinolinyl)thio]-N-(4-ethylphenyl)acetamide IUPAC Name: 2-(3-cyano-6,7-dimethoxyquinolin-2-yl)sulfanyl-N-(4-ethylphenyl)acetamide Traditional Name: 2-[(3-cyano-6,7-dimethoxy-2-quinolyl)thio]-N-(4-ethylphenyl)acetamide Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)CSC2=NC3=CC(=C(C=C3C=C2C#N)OC)OC

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)CSC2=NC3=CC(=C(C=C3C=C2C#N)OC)OC

InChI

InChI=1S/C22H21N3O3S/c1-4-14-5-7-17(8-6-14)24-21(26)13-29-22-16(12-23)9-15-10-19(27-2)20(28-3)11-18(15)25-22/h5-11H,4,13H2,1-3H3,(H,24,26)