ethyl 4-(2-chloranyl-5-cyano-pyrimidin-4-yl)piperazine-1-carboxylate

Systemtic Name: ethyl 4-(2-chloranyl-5-cyano-pyrimidin-4-yl)piperazine-1-carboxylate Openeye Name: ethyl 4-(2-chloro-5-cyano-pyrimidin-4-yl)piperazine-1-carboxylate CAS Name: 4-(2-chloro-5-cyano-4-pyrimidinyl)-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-chloro-5-cyanopyrimidin-4-yl)piperazine-1-carboxylate Traditional Name: 4-(2-chloro-5-cyano-pyrimidin-4-yl)piperazine-1-carboxylic acid ethyl ester Formula: C12H14ClN5O2 MolecularWeight: 295.72486

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=NC(=NC=C2C#N)Cl

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=NC(=NC=C2C#N)Cl

InChI

InChI=1S/C12H14ClN5O2/c1-2-20-12(19)18-5-3-17(4-6-18)10-9(7-14)8-15-11(13)16-10/h8H,2-6H2,1H3