N-[4-bromanyl-1-[(4-fluorophenyl)methyl]pyrazol-3-yl]-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide

Systemtic Name: N-[4-bromanyl-1-[(4-fluorophenyl)methyl]pyrazol-3-yl]-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide Openeye Name: N-[4-bromo-1-[(4-fluorophenyl)methyl]pyrazol-3-yl]-5-(p-tolyl)isoxazole-3-carboxamide CAS Name: N-[4-bromo-1-[(4-fluorophenyl)methyl]-3-pyrazolyl]-5-(4-methylphenyl)-3-isoxazolecarboxamide IUPAC Name: N-[4-bromo-1-[(4-fluorophenyl)methyl]pyrazol-3-yl]-5-(4-methylphenyl)-1,2-oxazole-3-carboxamide Traditional Name: N-[4-bromo-1-(4-fluorobenzyl)pyrazol-3-yl]-5-(p-tolyl)isoxazole-3-carboxamide Formula: C21H16BrFN4O2 MolecularWeight: 455.279743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NO2)C(=O)NC3=NN(C=C3Br)CC4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NO2)C(=O)NC3=NN(C=C3Br)CC4=CC=C(C=C4)F

InChI

InChI=1S/C21H16BrFN4O2/c1-13-2-6-15(7-3-13)19-10-18(26-29-19)21(28)24-20-17(22)12-27(25-20)11-14-4-8-16(23)9-5-14/h2-10,12H,11H2,1H3,(H,24,25,28)