ethyl 4-[5-(2-chloranyl-6-fluoranyl-phenyl)pyrimidin-2-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[5-(2-chloranyl-6-fluoranyl-phenyl)pyrimidin-2-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[5-(2-chloro-6-fluoro-phenyl)pyrimidin-2-yl]piperazine-1-carboxylate CAS Name: 4-[5-(2-chloro-6-fluorophenyl)-2-pyrimidinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[5-(2-chloro-6-fluorophenyl)pyrimidin-2-yl]piperazine-1-carboxylate Traditional Name: 4-[5-(2-chloro-6-fluoro-phenyl)pyrimidin-2-yl]piperazine-1-carboxylic acid ethyl ester Formula: C17H18ClFN4O2 MolecularWeight: 364.801823

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=NC=C(C=N2)C3=C(C=CC=C3Cl)F

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=NC=C(C=N2)C3=C(C=CC=C3Cl)F

InChI

InChI=1S/C17H18ClFN4O2/c1-2-25-17(24)23-8-6-22(7-9-23)16-20-10-12(11-21-16)15-13(18)4-3-5-14(15)19/h3-5,10-11H,2,6-9H2,1H3