2-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-4-(trifluoromethyl)pyrimidine

Systemtic Name: 2-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-4-(trifluoromethyl)pyrimidine Openeye Name: 2-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-4-(trifluoromethyl)pyrimidine CAS Name: 2-[4-[(2,5-dimethoxyphenyl)methyl]-1-piperazinyl]-4-(trifluoromethyl)pyrimidine IUPAC Name: 2-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-4-(trifluoromethyl)pyrimidine Traditional Name: 2-[4-(2,5-dimethoxybenzyl)piperazino]-4-(trifluoromethyl)pyrimidine Formula: C18H21F3N4O2 MolecularWeight: 382.38015

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CN2CCN(CC2)C3=NC=CC(=N3)C(F)(F)F

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CN2CCN(CC2)C3=NC=CC(=N3)C(F)(F)F

InChI

InChI=1S/C18H21F3N4O2/c1-26-14-3-4-15(27-2)13(11-14)12-24-7-9-25(10-8-24)17-22-6-5-16(23-17)18(19,20)21/h3-6,11H,7-10,12H2,1-2H3