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

Systemtic Name: 4-[4-(4-aminophenyl)sulfanylquinolin-2-yl]-5-methyl-1,2-dihydropyrazol-3-one Openeye Name: 4-[4-(4-aminophenyl)sulfanyl-2-quinolyl]-5-methyl-1,2-dihydropyrazol-3-one CAS Name: 4-[4-[(4-aminophenyl)thio]-2-quinolinyl]-5-methyl-1,2-dihydropyrazol-3-one IUPAC Name: 4-[4-(4-aminophenyl)sulfanylquinolin-2-yl]-5-methyl-1,2-dihydropyrazol-3-one Traditional Name: 4-[4-[(4-aminophenyl)thio]-2-quinolyl]-5-methyl-3-pyrazolin-3-one Formula: C19H16N4OS MolecularWeight: 348.42154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16N4OS/c1-11-18(19(24)23-22-11)16-10-17(14-4-2-3-5-15(14)21-16)25-13-8-6-12(20)7-9-13/h2-10H,20H2,1H3,(H2,22,23,24)