2-tert-butyl-4-[4-[4-(5-methyl-4-phenylmethoxy-pyrimidin-2-yl)oxybutyl]piperazin-1-yl]-6-(trifluoromethyl)pyrimidine

Systemtic Name: 2-tert-butyl-4-[4-[4-(5-methyl-4-phenylmethoxy-pyrimidin-2-yl)oxybutyl]piperazin-1-yl]-6-(trifluoromethyl)pyrimidine Openeye Name: 4-benzyloxy-2-[4-[4-[2-tert-butyl-6-(trifluoromethyl)pyrimidin-4-yl]piperazin-1-yl]butoxy]-5-methyl-pyrimidine CAS Name: 2-tert-butyl-4-[4-[4-[(5-methyl-4-phenylmethoxy-2-pyrimidinyl)oxy]butyl]-1-piperazinyl]-6-(trifluoromethyl)pyrimidine IUPAC Name: 2-tert-butyl-4-[4-[4-(5-methyl-4-phenylmethoxypyrimidin-2-yl)oxybutyl]piperazin-1-yl]-6-(trifluoromethyl)pyrimidine Traditional Name: 4-benzoxy-2-[4-[4-[2-tert-butyl-6-(trifluoromethyl)pyrimidin-4-yl]piperazino]butoxy]-5-methyl-pyrimidine Formula: C29H37F3N6O2 MolecularWeight: 558.63829

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1OCC2=CC=CC=C2)OCCCCN3CCN(CC3)C4=NC(=NC(=C4)C(F)(F)F)C(C)(C)C

Isomeric SMILES

CC1=CN=C(N=C1OCC2=CC=CC=C2)OCCCCN3CCN(CC3)C4=NC(=NC(=C4)C(F)(F)F)C(C)(C)C

InChI

InChI=1S/C29H37F3N6O2/c1-21-19-33-27(36-25(21)40-20-22-10-6-5-7-11-22)39-17-9-8-12-37-13-15-38(16-14-37)24-18-23(29(30,31)32)34-26(35-24)28(2,3)4/h5-7,10-11,18-19H,8-9,12-17,20H2,1-4H3