methyl 2-[[1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-yl-pyrazol-4-yl]carbonylamino]benzoate

Systemtic Name: methyl 2-[[1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-yl-pyrazol-4-yl]carbonylamino]benzoate Openeye Name: methyl 2-[[1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-yl-pyrazole-4-carbonyl]amino]benzoate CAS Name: 2-[[[1-(4-fluorophenyl)-3-methyl-5-(1-pyrrolyl)-4-pyrazolyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-ylpyrazole-4-carbonyl]amino]benzoate Traditional Name: 2-[[1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-yl-pyrazole-4-carbonyl]amino]benzoic acid methyl ester Formula: C23H19FN4O3 MolecularWeight: 418.420363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2=CC=CC=C2C(=O)OC)N3C=CC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2=CC=CC=C2C(=O)OC)N3C=CC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H19FN4O3/c1-15-20(21(29)25-19-8-4-3-7-18(19)23(30)31-2)22(27-13-5-6-14-27)28(26-15)17-11-9-16(24)10-12-17/h3-14H,1-2H3,(H,25,29)