5-(3,4-dimethoxyphenyl)-3-(4-fluorophenyl)-2-(phenylsulfonyl)-3,4-dihydropyrazole

Systemtic Name: 5-(3,4-dimethoxyphenyl)-3-(4-fluorophenyl)-2-(phenylsulfonyl)-3,4-dihydropyrazole Openeye Name: 2-(benzenesulfonyl)-5-(3,4-dimethoxyphenyl)-3-(4-fluorophenyl)-3,4-dihydropyrazole CAS Name: 2-(benzenesulfonyl)-5-(3,4-dimethoxyphenyl)-3-(4-fluorophenyl)-3,4-dihydropyrazole IUPAC Name: 2-(benzenesulfonyl)-5-(3,4-dimethoxyphenyl)-3-(4-fluorophenyl)-3,4-dihydropyrazole Traditional Name: 1-besyl-3-(3,4-dimethoxyphenyl)-5-(4-fluorophenyl)-2-pyrazoline Formula: C23H21FN2O4S MolecularWeight: 440.487243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C(C2)C3=CC=C(C=C3)F)S(=O)(=O)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C(C2)C3=CC=C(C=C3)F)S(=O)(=O)C4=CC=CC=C4)OC

InChI

InChI=1S/C23H21FN2O4S/c1-29-22-13-10-17(14-23(22)30-2)20-15-21(16-8-11-18(24)12-9-16)26(25-20)31(27,28)19-6-4-3-5-7-19/h3-14,21H,15H2,1-2H3