N-(4-bromanyl-2-fluoranyl-phenyl)-4-methoxy-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-4-methoxy-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-4-methoxy-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxamide CAS Name: N-(4-bromo-2-fluorophenyl)-4-methoxy-1-[3-(trifluoromethyl)phenyl]-3-pyrazolecarboxamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-4-methoxy-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-4-methoxy-1-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxamide Formula: C18H12BrF4N3O2 MolecularWeight: 458.204393

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CN(N=C1C(=O)NC2=C(C=C(C=C2)Br)F)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

COC1=CN(N=C1C(=O)NC2=C(C=C(C=C2)Br)F)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C18H12BrF4N3O2/c1-28-15-9-26(12-4-2-3-10(7-12)18(21,22)23)25-16(15)17(27)24-14-6-5-11(19)8-13(14)20/h2-9H,1H3,(H,24,27)