5-methyl-4-(4-phenylsulfanylquinolin-2-yl)-1,2-dihydropyrazol-3-one

Systemtic Name: 5-methyl-4-(4-phenylsulfanylquinolin-2-yl)-1,2-dihydropyrazol-3-one Openeye Name: 5-methyl-4-(4-phenylsulfanyl-2-quinolyl)-1,2-dihydropyrazol-3-one CAS Name: 5-methyl-4-[4-(phenylthio)-2-quinolinyl]-1,2-dihydropyrazol-3-one IUPAC Name: 5-methyl-4-(4-phenylsulfanylquinolin-2-yl)-1,2-dihydropyrazol-3-one Traditional Name: 5-methyl-4-[4-(phenylthio)-2-quinolyl]-3-pyrazolin-3-one Formula: C19H15N3OS MolecularWeight: 333.4069

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NN1)C2=NC3=CC=CC=C3C(=C2)SC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)NN1)C2=NC3=CC=CC=C3C(=C2)SC4=CC=CC=C4

InChI

InChI=1S/C19H15N3OS/c1-12-18(19(23)22-21-12)16-11-17(24-13-7-3-2-4-8-13)14-9-5-6-10-15(14)20-16/h2-11H,1H3,(H2,21,22,23)