1-[3-[5-azanyl-1-(4-fluorophenyl)pyrazol-4-yl]carbonylphenyl]-2-bromanyl-ethanone

Systemtic Name: 1-[3-[5-azanyl-1-(4-fluorophenyl)pyrazol-4-yl]carbonylphenyl]-2-bromanyl-ethanone Openeye Name: 1-[3-[5-amino-1-(4-fluorophenyl)pyrazole-4-carbonyl]phenyl]-2-bromo-ethanone CAS Name: 1-[3-[[5-amino-1-(4-fluorophenyl)-4-pyrazolyl]-oxomethyl]phenyl]-2-bromoethanone IUPAC Name: 1-[3-[5-amino-1-(4-fluorophenyl)pyrazole-4-carbonyl]phenyl]-2-bromoethanone Traditional Name: 1-[3-[5-amino-1-(4-fluorophenyl)pyrazole-4-carbonyl]phenyl]-2-bromo-ethanone Formula: C18H13BrFN3O2 MolecularWeight: 402.217123

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)CBr)C(=O)C2=C(N(N=C2)C3=CC=C(C=C3)F)N

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)CBr)C(=O)C2=C(N(N=C2)C3=CC=C(C=C3)F)N

InChI

InChI=1S/C18H13BrFN3O2/c19-9-16(24)11-2-1-3-12(8-11)17(25)15-10-22-23(18(15)21)14-6-4-13(20)5-7-14/h1-8,10H,9,21H2