5-(methylamino)-2,4-bis[3-(trifluoromethyl)phenyl]pyridazin-3-one

Systemtic Name: 5-(methylamino)-2,4-bis[3-(trifluoromethyl)phenyl]pyridazin-3-one Openeye Name: 5-(methylamino)-2,4-bis[3-(trifluoromethyl)phenyl]pyridazin-3-one CAS Name: 5-(methylamino)-2,4-bis[3-(trifluoromethyl)phenyl]-3-pyridazinone IUPAC Name: 5-(methylamino)-2,4-bis[3-(trifluoromethyl)phenyl]pyridazin-3-one Traditional Name: 5-(methylamino)-2,4-bis[3-(trifluoromethyl)phenyl]pyridazin-3-one Formula: C19H13F6N3O MolecularWeight: 413.316439

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C(=O)N(N=C1)C2=CC=CC(=C2)C(F)(F)F)C3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CNC1=C(C(=O)N(N=C1)C2=CC=CC(=C2)C(F)(F)F)C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C19H13F6N3O/c1-26-15-10-27-28(14-7-3-6-13(9-14)19(23,24)25)17(29)16(15)11-4-2-5-12(8-11)18(20,21)22/h2-10,26H,1H3