N5-[(5-bromanyl-2-fluoranyl-phenyl)methyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide

Systemtic Name: N5-[(5-bromanyl-2-fluoranyl-phenyl)methyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide Openeye Name: N5-[(5-bromo-2-fluoro-phenyl)methyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide CAS Name: N5-[(5-bromo-2-fluorophenyl)methyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide IUPAC Name: 5-N-[(5-bromo-2-fluorophenyl)methyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide Traditional Name: N-(5-bromo-2-fluoro-benzyl)-1-phenyl-2-pyrazoline-3,5-dicarboxamide Formula: C18H16BrFN4O2 MolecularWeight: 419.247643

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C(=O)NCC2=C(C=CC(=C2)Br)F)C3=CC=CC=C3)C(=O)N

Isomeric SMILES

C1C(N(N=C1C(=O)NCC2=C(C=CC(=C2)Br)F)C3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C18H16BrFN4O2/c19-12-6-7-14(20)11(8-12)10-22-18(26)15-9-16(17(21)25)24(23-15)13-4-2-1-3-5-13/h1-8,16H,9-10H2,(H2,21,25)(H,22,26)