2-[3-(4-methylphenyl)-2-(4-sulfamoylphenyl)-3,4-dihydropyrazol-5-yl]ethanoate

Systemtic Name: 2-[3-(4-methylphenyl)-2-(4-sulfamoylphenyl)-3,4-dihydropyrazol-5-yl]ethanoate Openeye Name: 2-[3-(p-tolyl)-2-(4-sulfamoylphenyl)-3,4-dihydropyrazol-5-yl]acetate CAS Name: 2-[3-(4-methylphenyl)-2-(4-sulfamoylphenyl)-3,4-dihydropyrazol-5-yl]acetate IUPAC Name: 2-[3-(4-methylphenyl)-2-(4-sulfamoylphenyl)-3,4-dihydropyrazol-5-yl]acetate Traditional Name: 2-[5-(p-tolyl)-1-(4-sulfamoylphenyl)-2-pyrazolin-3-yl]acetate Formula: C18H18N3O4S- MolecularWeight: 372.41822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)CC(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)CC(=O)[O-]

InChI

InChI=1S/C18H19N3O4S/c1-12-2-4-13(5-3-12)17-10-14(11-18(22)23)20-21(17)15-6-8-16(9-7-15)26(19,24)25/h2-9,17H,10-11H2,1H3,(H,22,23)(H2,19,24,25)/p-1