2-(3-cyano-5,7-dimethyl-quinolin-2-yl)sulfanyl-N-(3,4-dimethylphenyl)ethanamide

Systemtic Name: 2-(3-cyano-5,7-dimethyl-quinolin-2-yl)sulfanyl-N-(3,4-dimethylphenyl)ethanamide Openeye Name: 2-[(3-cyano-5,7-dimethyl-2-quinolyl)sulfanyl]-N-(3,4-dimethylphenyl)acetamide CAS Name: 2-[(3-cyano-5,7-dimethyl-2-quinolinyl)thio]-N-(3,4-dimethylphenyl)acetamide IUPAC Name: 2-(3-cyano-5,7-dimethylquinolin-2-yl)sulfanyl-N-(3,4-dimethylphenyl)acetamide Traditional Name: 2-[(3-cyano-5,7-dimethyl-2-quinolyl)thio]-N-(3,4-dimethylphenyl)acetamide Formula: C22H21N3OS MolecularWeight: 375.48664

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21N3OS/c1-13-7-16(4)19-10-17(11-23)22(25-20(19)8-13)27-12-21(26)24-18-6-5-14(2)15(3)9-18/h5-10H,12H2,1-4H3,(H,24,26)