N-[2-bromanyl-4,6-bis(fluoranyl)phenyl]-3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: N-[2-bromanyl-4,6-bis(fluoranyl)phenyl]-3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: N-(2-bromo-4,6-difluoro-phenyl)-3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: N-(2-bromo-4,6-difluorophenyl)-3-methyl-1-phenyl-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: N-(2-bromo-4,6-difluorophenyl)-3-methyl-1-phenyl-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: N-(2-bromo-4,6-difluoro-phenyl)-3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C21H15BrF2N4O MolecularWeight: 457.270806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2=C(C=C(C=C2Br)F)F)N3C=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2=C(C=C(C=C2Br)F)F)N3C=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H15BrF2N4O/c1-13-18(20(29)25-19-16(22)11-14(23)12-17(19)24)21(27-9-5-6-10-27)28(26-13)15-7-3-2-4-8-15/h2-12H,1H3,(H,25,29)