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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OC)NC(=O)C2=C(N(N=C2)C3=CC=CC=C3F)N4C=CC=C4

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OC)NC(=O)C2=C(N(N=C2)C3=CC=CC=C3F)N4C=CC=C4

InChI

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