2-(3-cyano-6,7-dimethyl-quinolin-2-yl)sulfanyl-N-(2-methylcyclohexyl)ethanamide

Systemtic Name: 2-(3-cyano-6,7-dimethyl-quinolin-2-yl)sulfanyl-N-(2-methylcyclohexyl)ethanamide Openeye Name: 2-[(3-cyano-6,7-dimethyl-2-quinolyl)sulfanyl]-N-(2-methylcyclohexyl)acetamide CAS Name: 2-[(3-cyano-6,7-dimethyl-2-quinolinyl)thio]-N-(2-methylcyclohexyl)acetamide IUPAC Name: 2-(3-cyano-6,7-dimethylquinolin-2-yl)sulfanyl-N-(2-methylcyclohexyl)acetamide Traditional Name: 2-[(3-cyano-6,7-dimethyl-2-quinolyl)thio]-N-(2-methylcyclohexyl)acetamide Formula: C21H25N3OS MolecularWeight: 367.5077

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)CSC2=NC3=CC(=C(C=C3C=C2C#N)C)C

Isomeric SMILES

CC1CCCCC1NC(=O)CSC2=NC3=CC(=C(C=C3C=C2C#N)C)C

InChI

InChI=1S/C21H25N3OS/c1-13-6-4-5-7-18(13)23-20(25)12-26-21-17(11-22)10-16-8-14(2)15(3)9-19(16)24-21/h8-10,13,18H,4-7,12H2,1-3H3,(H,23,25)