1-[4-[4-[2-tert-butyl-6-(trifluoromethyl)pyrimidin-4-yl]piperazin-1-yl]butyl]-5-methyl-4-phenoxy-pyrimidin-2-one

Systemtic Name: 1-[4-[4-[2-tert-butyl-6-(trifluoromethyl)pyrimidin-4-yl]piperazin-1-yl]butyl]-5-methyl-4-phenoxy-pyrimidin-2-one Openeye Name: 1-[4-[4-[2-tert-butyl-6-(trifluoromethyl)pyrimidin-4-yl]piperazin-1-yl]butyl]-5-methyl-4-phenoxy-pyrimidin-2-one CAS Name: 1-[4-[4-[2-tert-butyl-6-(trifluoromethyl)-4-pyrimidinyl]-1-piperazinyl]butyl]-5-methyl-4-phenoxy-2-pyrimidinone IUPAC Name: 1-[4-[4-[2-tert-butyl-6-(trifluoromethyl)pyrimidin-4-yl]piperazin-1-yl]butyl]-5-methyl-4-phenoxypyrimidin-2-one Traditional Name: 1-[4-[4-[2-tert-butyl-6-(trifluoromethyl)pyrimidin-4-yl]piperazino]butyl]-5-methyl-4-phenoxy-pyrimidin-2-one Formula: C28H35F3N6O2 MolecularWeight: 544.61171

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)N=C1OC2=CC=CC=C2)CCCCN3CCN(CC3)C4=NC(=NC(=C4)C(F)(F)F)C(C)(C)C

Isomeric SMILES

CC1=CN(C(=O)N=C1OC2=CC=CC=C2)CCCCN3CCN(CC3)C4=NC(=NC(=C4)C(F)(F)F)C(C)(C)C

InChI

InChI=1S/C28H35F3N6O2/c1-20-19-37(26(38)34-24(20)39-21-10-6-5-7-11-21)13-9-8-12-35-14-16-36(17-15-35)23-18-22(28(29,30)31)32-25(33-23)27(2,3)4/h5-7,10-11,18-19H,8-9,12-17H2,1-4H3