4-[(3R)-5-[3-(methylsulfonylamino)phenyl]-3-phenyl-3,4-dihydropyrazol-2-yl]-4-oxidanylidene-butanoate

Systemtic Name: 4-[(3R)-5-[3-(methylsulfonylamino)phenyl]-3-phenyl-3,4-dihydropyrazol-2-yl]-4-oxidanylidene-butanoate Openeye Name: 4-[(3R)-5-[3-(methanesulfonamido)phenyl]-3-phenyl-3,4-dihydropyrazol-2-yl]-4-oxo-butanoate CAS Name: 4-[(3R)-5-[3-(methanesulfonamido)phenyl]-3-phenyl-3,4-dihydropyrazol-2-yl]-4-oxobutanoate IUPAC Name: 4-[(3R)-5-[3-(methanesulfonamido)phenyl]-3-phenyl-3,4-dihydropyrazol-2-yl]-4-oxobutanoate Traditional Name: 4-keto-4-[(5R)-3-[3-(methanesulfonamido)phenyl]-5-phenyl-2-pyrazolin-1-yl]butyrate Formula: C20H20N3O5S- MolecularWeight: 414.4549

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=CC(=C1)C2=NN(C(C2)C3=CC=CC=C3)C(=O)CCC(=O)[O-]

Isomeric SMILES

CS(=O)(=O)NC1=CC=CC(=C1)C2=NN([C@H](C2)C3=CC=CC=C3)C(=O)CCC(=O)[O-]

InChI

InChI=1S/C20H21N3O5S/c1-29(27,28)22-16-9-5-8-15(12-16)17-13-18(14-6-3-2-4-7-14)23(21-17)19(24)10-11-20(25)26/h2-9,12,18,22H,10-11,13H2,1H3,(H,25,26)/p-1/t18-/m1/s1