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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)CSC2=NC3=CC(=C(C=C3C=C2C#N)OC)OC)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)CSC2=NC3=CC(=C(C=C3C=C2C#N)OC)OC)C

InChI

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