6-methyl-4-oxidanylidene-N-[2-(4-phenylpiperazin-1-yl)ethyl]-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide

Systemtic Name: 6-methyl-4-oxidanylidene-N-[2-(4-phenylpiperazin-1-yl)ethyl]-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide Openeye Name: 6-methyl-4-oxo-N-[2-(4-phenylpiperazin-1-yl)ethyl]-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide CAS Name: 6-methyl-4-oxo-N-[2-(4-phenyl-1-piperazinyl)ethyl]-1-[2-(trifluoromethyl)phenyl]-3-pyridazinecarboxamide IUPAC Name: 6-methyl-4-oxo-N-[2-(4-phenylpiperazin-1-yl)ethyl]-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide Traditional Name: 4-keto-6-methyl-N-[2-(4-phenylpiperazino)ethyl]-1-[2-(trifluoromethyl)phenyl]pyridazine-3-carboxamide Formula: C25H26F3N5O2 MolecularWeight: 485.50145

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC=C2C(F)(F)F)C(=O)NCCN3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC=C2C(F)(F)F)C(=O)NCCN3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C25H26F3N5O2/c1-18-17-22(34)23(30-33(18)21-10-6-5-9-20(21)25(26,27)28)24(35)29-11-12-31-13-15-32(16-14-31)19-7-3-2-4-8-19/h2-10,17H,11-16H2,1H3,(H,29,35)