N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-quinolin-2-ylsulfanyl-ethanamide

Systemtic Name: N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-quinolin-2-ylsulfanyl-ethanamide Openeye Name: N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-(2-quinolylsulfanyl)acetamide CAS Name: N-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-2-(2-quinolinylthio)acetamide IUPAC Name: N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-2-quinolin-2-ylsulfanylacetamide Traditional Name: N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-(2-quinolylthio)acetamide Formula: C22H20N4OS MolecularWeight: 388.4854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)CSC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)CSC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H20N4OS/c1-15-22(16(2)26(25-15)18-9-4-3-5-10-18)24-20(27)14-28-21-13-12-17-8-6-7-11-19(17)23-21/h3-13H,14H2,1-2H3,(H,24,27)