5-[[1-[(2-fluorophenyl)methyl]pyrazol-4-yl]carbamoyl]-1-methyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-[[1-[(2-fluorophenyl)methyl]pyrazol-4-yl]carbamoyl]-1-methyl-pyrazole-4-carboxylic acid Openeye Name: 5-[[1-[(2-fluorophenyl)methyl]pyrazol-4-yl]carbamoyl]-1-methyl-pyrazole-4-carboxylic acid CAS Name: 5-[[[1-[(2-fluorophenyl)methyl]-4-pyrazolyl]amino]-oxomethyl]-1-methyl-4-pyrazolecarboxylic acid IUPAC Name: 5-[[1-[(2-fluorophenyl)methyl]pyrazol-4-yl]carbamoyl]-1-methylpyrazole-4-carboxylic acid Traditional Name: 5-[[1-(2-fluorobenzyl)pyrazol-4-yl]carbamoyl]-1-methyl-pyrazole-4-carboxylic acid Formula: C16H14FN5O3 MolecularWeight: 343.312463

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C(=O)O)C(=O)NC2=CN(N=C2)CC3=CC=CC=C3F

Isomeric SMILES

CN1C(=C(C=N1)C(=O)O)C(=O)NC2=CN(N=C2)CC3=CC=CC=C3F

InChI

InChI=1S/C16H14FN5O3/c1-21-14(12(7-18-21)16(24)25)15(23)20-11-6-19-22(9-11)8-10-4-2-3-5-13(10)17/h2-7,9H,8H2,1H3,(H,20,23)(H,24,25)