[5-azanyl-1-(4-fluorophenyl)pyrazol-4-yl]-[3-(2-bromoethyloxy)phenyl]methanone

Systemtic Name: [5-azanyl-1-(4-fluorophenyl)pyrazol-4-yl]-[3-(2-bromoethyloxy)phenyl]methanone Openeye Name: [5-amino-1-(4-fluorophenyl)pyrazol-4-yl]-[3-(2-bromoethoxy)phenyl]methanone CAS Name: [5-amino-1-(4-fluorophenyl)-4-pyrazolyl]-[3-(2-bromoethoxy)phenyl]methanone IUPAC Name: [5-amino-1-(4-fluorophenyl)pyrazol-4-yl]-[3-(2-bromoethoxy)phenyl]methanone Traditional Name: [5-amino-1-(4-fluorophenyl)pyrazol-4-yl]-[3-(2-bromoethoxy)phenyl]methanone Formula: C18H15BrFN3O2 MolecularWeight: 404.233003

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15BrFN3O2/c19-8-9-25-15-3-1-2-12(10-15)17(24)16-11-22-23(18(16)21)14-6-4-13(20)5-7-14/h1-7,10-11H,8-9,21H2