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

Systemtic Name: 4-[4-(4-aminophenyl)sulfanylquinolin-2-yl]-5-cyclohexyl-1,2-dihydropyrazol-3-one Openeye Name: 4-[4-(4-aminophenyl)sulfanyl-2-quinolyl]-5-cyclohexyl-1,2-dihydropyrazol-3-one CAS Name: 4-[4-[(4-aminophenyl)thio]-2-quinolinyl]-5-cyclohexyl-1,2-dihydropyrazol-3-one IUPAC Name: 4-[4-(4-aminophenyl)sulfanylquinolin-2-yl]-5-cyclohexyl-1,2-dihydropyrazol-3-one Traditional Name: 4-[4-[(4-aminophenyl)thio]-2-quinolyl]-5-cyclohexyl-3-pyrazolin-3-one Formula: C24H24N4OS MolecularWeight: 416.53856

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(C(=O)NN2)C3=NC4=CC=CC=C4C(=C3)SC5=CC=C(C=C5)N

Isomeric SMILES

C1CCC(CC1)C2=C(C(=O)NN2)C3=NC4=CC=CC=C4C(=C3)SC5=CC=C(C=C5)N

InChI

InChI=1S/C24H24N4OS/c25-16-10-12-17(13-11-16)30-21-14-20(26-19-9-5-4-8-18(19)21)22-23(27-28-24(22)29)15-6-2-1-3-7-15/h4-5,8-15H,1-3,6-7,25H2,(H2,27,28,29)