methyl 4-fluoranyl-3-[(1-phenyl-5-propan-2-yl-pyrazol-4-yl)carbonylamino]benzoate

Systemtic Name: methyl 4-fluoranyl-3-[(1-phenyl-5-propan-2-yl-pyrazol-4-yl)carbonylamino]benzoate Openeye Name: methyl 4-fluoro-3-[(5-isopropyl-1-phenyl-pyrazole-4-carbonyl)amino]benzoate CAS Name: 4-fluoro-3-[[oxo-(1-phenyl-5-propan-2-yl-4-pyrazolyl)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-fluoro-3-[(1-phenyl-5-propan-2-ylpyrazole-4-carbonyl)amino]benzoate Traditional Name: 4-fluoro-3-[(5-isopropyl-1-phenyl-pyrazole-4-carbonyl)amino]benzoic acid methyl ester Formula: C21H20FN3O3 MolecularWeight: 381.400203

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=NN1C2=CC=CC=C2)C(=O)NC3=C(C=CC(=C3)C(=O)OC)F

Isomeric SMILES

CC(C)C1=C(C=NN1C2=CC=CC=C2)C(=O)NC3=C(C=CC(=C3)C(=O)OC)F

InChI

InChI=1S/C21H20FN3O3/c1-13(2)19-16(12-23-25(19)15-7-5-4-6-8-15)20(26)24-18-11-14(21(27)28-3)9-10-17(18)22/h4-13H,1-3H3,(H,24,26)