2-[3-[[phenylsulfonyl-[(4-pyrazol-1-ylphenyl)methyl]amino]methyl]phenoxy]ethanoic acid

Systemtic Name: 2-[3-[[phenylsulfonyl-[(4-pyrazol-1-ylphenyl)methyl]amino]methyl]phenoxy]ethanoic acid Openeye Name: 2-[3-[[benzenesulfonyl-[(4-pyrazol-1-ylphenyl)methyl]amino]methyl]phenoxy]acetic acid CAS Name: 2-[3-[[benzenesulfonyl-[[4-(1-pyrazolyl)phenyl]methyl]amino]methyl]phenoxy]acetic acid IUPAC Name: 2-[3-[[benzenesulfonyl-[(4-pyrazol-1-ylphenyl)methyl]amino]methyl]phenoxy]acetic acid Traditional Name: 2-[3-[[besyl-(4-pyrazol-1-ylbenzyl)amino]methyl]phenoxy]acetic acid Formula: C25H23N3O5S MolecularWeight: 477.53222

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)N3C=CC=N3)CC4=CC(=CC=C4)OCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)N3C=CC=N3)CC4=CC(=CC=C4)OCC(=O)O

InChI

InChI=1S/C25H23N3O5S/c29-25(30)19-33-23-7-4-6-21(16-23)18-27(34(31,32)24-8-2-1-3-9-24)17-20-10-12-22(13-11-20)28-15-5-14-26-28/h1-16H,17-19H2,(H,29,30)