ethyl 4-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[4-(2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]piperazine-1-carboxylate CAS Name: 4-[4-thiophen-2-yl-6-(trifluoromethyl)-2-pyrimidinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]piperazine-1-carboxylate Traditional Name: 4-[4-(2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]piperazine-1-carboxylic acid ethyl ester Formula: C16H17F3N4O2S MolecularWeight: 386.39199

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=NC(=CC(=N2)C(F)(F)F)C3=CC=CS3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=NC(=CC(=N2)C(F)(F)F)C3=CC=CS3

InChI

InChI=1S/C16H17F3N4O2S/c1-2-25-15(24)23-7-5-22(6-8-23)14-20-11(12-4-3-9-26-12)10-13(21-14)16(17,18)19/h3-4,9-10H,2,5-8H2,1H3