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

Systemtic Name: 2-(3-cyano-6,7-dimethoxy-quinolin-2-yl)sulfanyl-N-(4-methoxyphenyl)ethanamide Openeye Name: 2-[(3-cyano-6,7-dimethoxy-2-quinolyl)sulfanyl]-N-(4-methoxyphenyl)acetamide CAS Name: 2-[(3-cyano-6,7-dimethoxy-2-quinolinyl)thio]-N-(4-methoxyphenyl)acetamide IUPAC Name: 2-(3-cyano-6,7-dimethoxyquinolin-2-yl)sulfanyl-N-(4-methoxyphenyl)acetamide Traditional Name: 2-[(3-cyano-6,7-dimethoxy-2-quinolyl)thio]-N-(4-methoxyphenyl)acetamide Formula: C21H19N3O4S MolecularWeight: 409.45826

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)CSC2=NC3=CC(=C(C=C3C=C2C#N)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)CSC2=NC3=CC(=C(C=C3C=C2C#N)OC)OC

InChI

InChI=1S/C21H19N3O4S/c1-26-16-6-4-15(5-7-16)23-20(25)12-29-21-14(11-22)8-13-9-18(27-2)19(28-3)10-17(13)24-21/h4-10H,12H2,1-3H3,(H,23,25)