2-[[5-ethyl-2-(3-methylpyridin-2-yl)-4-phenyl-pyrazol-3-yl]amino]-5-methyl-benzoic acid

Systemtic Name: 2-[[5-ethyl-2-(3-methylpyridin-2-yl)-4-phenyl-pyrazol-3-yl]amino]-5-methyl-benzoic acid Openeye Name: 2-[[5-ethyl-2-(3-methyl-2-pyridyl)-4-phenyl-pyrazol-3-yl]amino]-5-methyl-benzoic acid CAS Name: 2-[[5-ethyl-2-(3-methyl-2-pyridinyl)-4-phenyl-3-pyrazolyl]amino]-5-methylbenzoic acid IUPAC Name: 2-[[5-ethyl-2-(3-methylpyridin-2-yl)-4-phenylpyrazol-3-yl]amino]-5-methylbenzoic acid Traditional Name: 2-[[5-ethyl-2-(3-methyl-2-pyridyl)-4-phenyl-pyrazol-3-yl]amino]-5-methyl-benzoic acid Formula: C25H24N4O2 MolecularWeight: 412.48366

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1C2=CC=CC=C2)NC3=C(C=C(C=C3)C)C(=O)O)C4=C(C=CC=N4)C

Isomeric SMILES

CCC1=NN(C(=C1C2=CC=CC=C2)NC3=C(C=C(C=C3)C)C(=O)O)C4=C(C=CC=N4)C

InChI

InChI=1S/C25H24N4O2/c1-4-20-22(18-10-6-5-7-11-18)24(29(28-20)23-17(3)9-8-14-26-23)27-21-13-12-16(2)15-19(21)25(30)31/h5-15,27H,4H2,1-3H3,(H,30,31)