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

Systemtic Name: 5-methyl-4-[4-(3-methylphenyl)sulfanylquinolin-2-yl]-1,2-dihydropyrazol-3-one Openeye Name: 5-methyl-4-[4-(m-tolylsulfanyl)-2-quinolyl]-1,2-dihydropyrazol-3-one CAS Name: 5-methyl-4-[4-[(3-methylphenyl)thio]-2-quinolinyl]-1,2-dihydropyrazol-3-one IUPAC Name: 5-methyl-4-[4-(3-methylphenyl)sulfanylquinolin-2-yl]-1,2-dihydropyrazol-3-one Traditional Name: 5-methyl-4-[4-(m-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=C1)SC2=CC(=NC3=CC=CC=C32)C4=C(NNC4=O)C

Isomeric SMILES

CC1=CC(=CC=C1)SC2=CC(=NC3=CC=CC=C32)C4=C(NNC4=O)C

InChI

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