1-cyclopentyl-3-[6-[4-[2-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]pyridazin-3-yl]urea

Systemtic Name: 1-cyclopentyl-3-[6-[4-[2-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]pyridazin-3-yl]urea Openeye Name: 1-cyclopentyl-3-[6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridazin-3-yl]urea CAS Name: 1-cyclopentyl-3-[6-[4-[oxo-[2-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]-3-pyridazinyl]urea IUPAC Name: 1-cyclopentyl-3-[6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridazin-3-yl]urea Traditional Name: 1-cyclopentyl-3-[6-[4-[2-(trifluoromethyl)benzoyl]piperazino]pyridazin-3-yl]urea Formula: C22H25F3N6O2 MolecularWeight: 462.46811

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)NC2=NN=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

C1CCC(C1)NC(=O)NC2=NN=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C22H25F3N6O2/c23-22(24,25)17-8-4-3-7-16(17)20(32)31-13-11-30(12-14-31)19-10-9-18(28-29-19)27-21(33)26-15-5-1-2-6-15/h3-4,7-10,15H,1-2,5-6,11-14H2,(H2,26,27,28,33)