ethyl 4-[5-[3-(trifluoromethyl)phenyl]pyrimidin-2-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[5-[3-(trifluoromethyl)phenyl]pyrimidin-2-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[5-[3-(trifluoromethyl)phenyl]pyrimidin-2-yl]piperazine-1-carboxylate CAS Name: 4-[5-[3-(trifluoromethyl)phenyl]-2-pyrimidinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[5-[3-(trifluoromethyl)phenyl]pyrimidin-2-yl]piperazine-1-carboxylate Traditional Name: 4-[5-[3-(trifluoromethyl)phenyl]pyrimidin-2-yl]piperazine-1-carboxylic acid ethyl ester Formula: C18H19F3N4O2 MolecularWeight: 380.36427

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=NC=C(C=N2)C3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=NC=C(C=N2)C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C18H19F3N4O2/c1-2-27-17(26)25-8-6-24(7-9-25)16-22-11-14(12-23-16)13-4-3-5-15(10-13)18(19,20)21/h3-5,10-12H,2,6-9H2,1H3