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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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