ethyl 4-[6-(2-fluorophenyl)-2-methyl-pyrimidin-4-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[6-(2-fluorophenyl)-2-methyl-pyrimidin-4-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[6-(2-fluorophenyl)-2-methyl-pyrimidin-4-yl]piperazine-1-carboxylate CAS Name: 4-[6-(2-fluorophenyl)-2-methyl-4-pyrimidinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[6-(2-fluorophenyl)-2-methylpyrimidin-4-yl]piperazine-1-carboxylate Traditional Name: 4-[6-(2-fluorophenyl)-2-methyl-pyrimidin-4-yl]piperazine-1-carboxylic acid ethyl ester Formula: C18H21FN4O2 MolecularWeight: 344.383343

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=NC(=NC(=C2)C3=CC=CC=C3F)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=NC(=NC(=C2)C3=CC=CC=C3F)C

InChI

InChI=1S/C18H21FN4O2/c1-3-25-18(24)23-10-8-22(9-11-23)17-12-16(20-13(2)21-17)14-6-4-5-7-15(14)19/h4-7,12H,3,8-11H2,1-2H3