5-methyl-4-[4-(2-methylphenyl)sulfanylquinolin-2-yl]-1,2-dihydropyrazol-3-one

Systemtic Name: 5-methyl-4-[4-(2-methylphenyl)sulfanylquinolin-2-yl]-1,2-dihydropyrazol-3-one Openeye Name: 5-methyl-4-[4-(o-tolylsulfanyl)-2-quinolyl]-1,2-dihydropyrazol-3-one CAS Name: 5-methyl-4-[4-[(2-methylphenyl)thio]-2-quinolinyl]-1,2-dihydropyrazol-3-one IUPAC Name: 5-methyl-4-[4-(2-methylphenyl)sulfanylquinolin-2-yl]-1,2-dihydropyrazol-3-one Traditional Name: 5-methyl-4-[4-(o-tolylthio)-2-quinolyl]-3-pyrazolin-3-one Formula: C20H17N3OS MolecularWeight: 347.43348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SC2=CC(=NC3=CC=CC=C32)C4=C(NNC4=O)C

Isomeric SMILES

CC1=CC=CC=C1SC2=CC(=NC3=CC=CC=C32)C4=C(NNC4=O)C

InChI

InChI=1S/C20H17N3OS/c1-12-7-3-6-10-17(12)25-18-11-16(19-13(2)22-23-20(19)24)21-15-9-5-4-8-14(15)18/h3-11H,1-2H3,(H2,22,23,24)