N-[4-[(5-oxidanylidene-4-quinolin-2-yl-1,2-dihydropyrazol-3-yl)methyl]phenyl]methanesulfonamide

Systemtic Name: N-[4-[(5-oxidanylidene-4-quinolin-2-yl-1,2-dihydropyrazol-3-yl)methyl]phenyl]methanesulfonamide Openeye Name: N-[4-[[5-oxo-4-(2-quinolyl)-1,2-dihydropyrazol-3-yl]methyl]phenyl]methanesulfonamide CAS Name: N-[4-[[5-oxo-4-(2-quinolinyl)-1,2-dihydropyrazol-3-yl]methyl]phenyl]methanesulfonamide IUPAC Name: N-[4-[(5-oxo-4-quinolin-2-yl-1,2-dihydropyrazol-3-yl)methyl]phenyl]methanesulfonamide Traditional Name: N-[4-[[5-keto-4-(2-quinolyl)-3-pyrazolin-3-yl]methyl]phenyl]methanesulfonamide Formula: C20H18N4O3S MolecularWeight: 394.44692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=C(C=C1)CC2=C(C(=O)NN2)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CS(=O)(=O)NC1=CC=C(C=C1)CC2=C(C(=O)NN2)C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C20H18N4O3S/c1-28(26,27)24-15-9-6-13(7-10-15)12-18-19(20(25)23-22-18)17-11-8-14-4-2-3-5-16(14)21-17/h2-11,24H,12H2,1H3,(H2,22,23,25)