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

Systemtic Name: 1-[3-[[3-azanyl-5-(4-fluorophenyl)-1H-pyrazol-4-yl]carbonyl]phenyl]-2-bromanyl-ethanone Openeye Name: 1-[3-[3-amino-5-(4-fluorophenyl)-1H-pyrazole-4-carbonyl]phenyl]-2-bromo-ethanone CAS Name: 1-[3-[[3-amino-5-(4-fluorophenyl)-1H-pyrazol-4-yl]-oxomethyl]phenyl]-2-bromoethanone IUPAC Name: 1-[3-[3-amino-5-(4-fluorophenyl)-1H-pyrazole-4-carbonyl]phenyl]-2-bromoethanone Traditional Name: 1-[3-[3-amino-5-(4-fluorophenyl)-1H-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(NN=C2N)C3=CC=C(C=C3)F

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)CBr)C(=O)C2=C(NN=C2N)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H13BrFN3O2/c19-9-14(24)11-2-1-3-12(8-11)17(25)15-16(22-23-18(15)21)10-4-6-13(20)7-5-10/h1-8H,9H2,(H3,21,22,23)