4-phenethyloxy-2-phenyl-5-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]pyridazin-3-one

Systemtic Name: 4-phenethyloxy-2-phenyl-5-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]pyridazin-3-one Openeye Name: 4-phenethyloxy-2-phenyl-5-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]pyridazin-3-one CAS Name: 4-phenethyloxy-2-phenyl-5-[4-[[3-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]-3-pyridazinone IUPAC Name: 4-phenethyloxy-2-phenyl-5-[4-[[3-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]pyridazin-3-one Traditional Name: 4-phenethyloxy-2-phenyl-5-[4-[3-(trifluoromethyl)benzyl]piperazino]pyridazin-3-one Formula: C30H29F3N4O2 MolecularWeight: 534.57207

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=CC=C2)C(F)(F)F)C3=C(C(=O)N(N=C3)C4=CC=CC=C4)OCCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC(=CC=C2)C(F)(F)F)C3=C(C(=O)N(N=C3)C4=CC=CC=C4)OCCC5=CC=CC=C5

InChI

InChI=1S/C30H29F3N4O2/c31-30(32,33)25-11-7-10-24(20-25)22-35-15-17-36(18-16-35)27-21-34-37(26-12-5-2-6-13-26)29(38)28(27)39-19-14-23-8-3-1-4-9-23/h1-13,20-21H,14-19,22H2