6-[4-[(4-fluoranyl-2-methyl-phenyl)carbamoyl]-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-olate

Systemtic Name: 6-[4-[(4-fluoranyl-2-methyl-phenyl)carbamoyl]-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-olate Openeye Name: 6-[4-[(4-fluoro-2-methyl-phenyl)carbamoyl]-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-olate CAS Name: 6-[4-[(4-fluoro-2-methylanilino)-oxomethyl]-5-(trifluoromethyl)-1-pyrazolyl]-3-pyridazinolate IUPAC Name: 6-[4-[(4-fluoro-2-methylphenyl)carbamoyl]-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-olate Traditional Name: 6-[4-[(4-fluoro-2-methyl-phenyl)carbamoyl]-5-(trifluoromethyl)pyrazol-1-yl]pyridazin-3-olate Formula: C16H10F4N5O2- MolecularWeight: 380.276513

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)NC(=O)C2=C(N(N=C2)C3=NN=C(C=C3)[O-])C(F)(F)F

Isomeric SMILES

CC1=C(C=CC(=C1)F)NC(=O)C2=C(N(N=C2)C3=NN=C(C=C3)[O-])C(F)(F)F

InChI

InChI=1S/C16H11F4N5O2/c1-8-6-9(17)2-3-11(8)22-15(27)10-7-21-25(14(10)16(18,19)20)12-4-5-13(26)24-23-12/h2-7H,1H3,(H,22,27)(H,24,26)/p-1