N-(4-cyano-2-methyl-pyrazol-3-yl)-2-(4,8-dimethylquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-cyano-2-methyl-pyrazol-3-yl)-2-(4,8-dimethylquinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-cyano-2-methyl-pyrazol-3-yl)-2-[(4,8-dimethyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(4-cyano-2-methyl-3-pyrazolyl)-2-[(4,8-dimethyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(4-cyano-2-methylpyrazol-3-yl)-2-(4,8-dimethylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(4-cyano-2-methyl-pyrazol-3-yl)-2-[(4,8-dimethyl-2-quinolyl)thio]acetamide Formula: C18H17N5OS MolecularWeight: 351.42548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)SCC(=O)NC3=C(C=NN3C)C#N

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)SCC(=O)NC3=C(C=NN3C)C#N

InChI

InChI=1S/C18H17N5OS/c1-11-5-4-6-14-12(2)7-16(22-17(11)14)25-10-15(24)21-18-13(8-19)9-20-23(18)3/h4-7,9H,10H2,1-3H3,(H,21,24)