2-[[3-[1-(2-methylpropyl)pyrazol-4-yl]phenyl]sulfonylamino]benzoic acid

Systemtic Name: 2-[[3-[1-(2-methylpropyl)pyrazol-4-yl]phenyl]sulfonylamino]benzoic acid Openeye Name: 2-[[3-(1-isobutylpyrazol-4-yl)phenyl]sulfonylamino]benzoic acid CAS Name: 2-[[3-[1-(2-methylpropyl)-4-pyrazolyl]phenyl]sulfonylamino]benzoic acid IUPAC Name: 2-[[3-[1-(2-methylpropyl)pyrazol-4-yl]phenyl]sulfonylamino]benzoic acid Traditional Name: 2-[[3-(1-isobutylpyrazol-4-yl)phenyl]sulfonylamino]benzoic acid Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C=C(C=N1)C2=CC(=CC=C2)S(=O)(=O)NC3=CC=CC=C3C(=O)O

Isomeric SMILES

CC(C)CN1C=C(C=N1)C2=CC(=CC=C2)S(=O)(=O)NC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C20H21N3O4S/c1-14(2)12-23-13-16(11-21-23)15-6-5-7-17(10-15)28(26,27)22-19-9-4-3-8-18(19)20(24)25/h3-11,13-14,22H,12H2,1-2H3,(H,24,25)