5-[azanyl(methyl)amino]-4-bromanyl-2-[3-(trifluoromethyl)phenyl]pyridazin-3-one

Systemtic Name: 5-[azanyl(methyl)amino]-4-bromanyl-2-[3-(trifluoromethyl)phenyl]pyridazin-3-one Openeye Name: 5-[amino(methyl)amino]-4-bromo-2-[3-(trifluoromethyl)phenyl]pyridazin-3-one CAS Name: 5-[amino(methyl)amino]-4-bromo-2-[3-(trifluoromethyl)phenyl]-3-pyridazinone IUPAC Name: 5-[amino(methyl)amino]-4-bromo-2-[3-(trifluoromethyl)phenyl]pyridazin-3-one Traditional Name: 5-[amino(methyl)amino]-4-bromo-2-[3-(trifluoromethyl)phenyl]pyridazin-3-one Formula: C12H10BrF3N4O MolecularWeight: 363.13321

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1=C(C(=O)N(N=C1)C2=CC=CC(=C2)C(F)(F)F)Br)N

Isomeric SMILES

CN(C1=C(C(=O)N(N=C1)C2=CC=CC(=C2)C(F)(F)F)Br)N

InChI

InChI=1S/C12H10BrF3N4O/c1-19(17)9-6-18-20(11(21)10(9)13)8-4-2-3-7(5-8)12(14,15)16/h2-6H,17H2,1H3