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

Systemtic Name: 5-[(3R)-5-[4-(methylsulfonylamino)phenyl]-3-phenyl-3,4-dihydropyrazol-2-yl]-5-oxidanylidene-pentanoate Openeye Name: 5-[(3R)-5-[4-(methanesulfonamido)phenyl]-3-phenyl-3,4-dihydropyrazol-2-yl]-5-oxo-pentanoate CAS Name: 5-[(3R)-5-[4-(methanesulfonamido)phenyl]-3-phenyl-3,4-dihydropyrazol-2-yl]-5-oxopentanoate IUPAC Name: 5-[(3R)-5-[4-(methanesulfonamido)phenyl]-3-phenyl-3,4-dihydropyrazol-2-yl]-5-oxopentanoate Traditional Name: 5-keto-5-[(5R)-3-[4-(methanesulfonamido)phenyl]-5-phenyl-2-pyrazolin-1-yl]valerate Formula: C21H22N3O5S- MolecularWeight: 428.48148

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O5S/c1-30(28,29)23-17-12-10-15(11-13-17)18-14-19(16-6-3-2-4-7-16)24(22-18)20(25)8-5-9-21(26)27/h2-4,6-7,10-13,19,23H,5,8-9,14H2,1H3,(H,26,27)/p-1/t19-/m1/s1