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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC(=C2)C(F)(F)F)C(=O)NCCN3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC(=C2)C(F)(F)F)C(=O)NCCN3CCN(CC3)C4=CC=CC=C4

InChI

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