N-(4-cyano-2-methyl-pyrazol-3-yl)-2-(4-methylquinolin-2-yl)sulfanyl-butanamide

Systemtic Name: N-(4-cyano-2-methyl-pyrazol-3-yl)-2-(4-methylquinolin-2-yl)sulfanyl-butanamide Openeye Name: N-(4-cyano-2-methyl-pyrazol-3-yl)-2-[(4-methyl-2-quinolyl)sulfanyl]butanamide CAS Name: N-(4-cyano-2-methyl-3-pyrazolyl)-2-[(4-methyl-2-quinolinyl)thio]butanamide IUPAC Name: N-(4-cyano-2-methylpyrazol-3-yl)-2-(4-methylquinolin-2-yl)sulfanylbutanamide Traditional Name: N-(4-cyano-2-methyl-pyrazol-3-yl)-2-[(4-methyl-2-quinolyl)thio]butyramide Formula: C19H19N5OS MolecularWeight: 365.45206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=NN1C)C#N)SC2=NC3=CC=CC=C3C(=C2)C

Isomeric SMILES

CCC(C(=O)NC1=C(C=NN1C)C#N)SC2=NC3=CC=CC=C3C(=C2)C

InChI

InChI=1S/C19H19N5OS/c1-4-16(19(25)23-18-13(10-20)11-21-24(18)3)26-17-9-12(2)14-7-5-6-8-15(14)22-17/h5-9,11,16H,4H2,1-3H3,(H,23,25)