N-[2,4-bis(fluoranyl)phenyl]-1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: N-[2,4-bis(fluoranyl)phenyl]-1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: N-(2,4-difluorophenyl)-1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: N-(2,4-difluorophenyl)-1-(4-fluorophenyl)-3-methyl-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-(2,4-difluorophenyl)-1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: N-(2,4-difluorophenyl)-1-(4-fluorophenyl)-3-methyl-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C21H15F3N4O MolecularWeight: 396.36521

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2=C(C=C(C=C2)F)F)N3C=CC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2=C(C=C(C=C2)F)F)N3C=CC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H15F3N4O/c1-13-19(20(29)25-18-9-6-15(23)12-17(18)24)21(27-10-2-3-11-27)28(26-13)16-7-4-14(22)5-8-16/h2-12H,1H3,(H,25,29)