N-(2-cyclopentylpyrazol-3-yl)-2-(4,8-dimethylquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-cyclopentylpyrazol-3-yl)-2-(4,8-dimethylquinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-cyclopentylpyrazol-3-yl)-2-[(4,8-dimethyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(2-cyclopentyl-3-pyrazolyl)-2-[(4,8-dimethyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(2-cyclopentylpyrazol-3-yl)-2-(4,8-dimethylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(2-cyclopentylpyrazol-3-yl)-2-[(4,8-dimethyl-2-quinolyl)thio]acetamide Formula: C21H24N4OS MolecularWeight: 380.50646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)SCC(=O)NC3=CC=NN3C4CCCC4

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)SCC(=O)NC3=CC=NN3C4CCCC4

InChI

InChI=1S/C21H24N4OS/c1-14-6-5-9-17-15(2)12-20(24-21(14)17)27-13-19(26)23-18-10-11-22-25(18)16-7-3-4-8-16/h5-6,9-12,16H,3-4,7-8,13H2,1-2H3,(H,23,26)