(5-chloranylpyridin-3-yl) 4-[2-(2-hydroxyethyl)pyrimidin-4-yl]-2,2-dimethyl-piperazine-1-carboxylate

Systemtic Name: (5-chloranylpyridin-3-yl) 4-[2-(2-hydroxyethyl)pyrimidin-4-yl]-2,2-dimethyl-piperazine-1-carboxylate Openeye Name: (5-chloro-3-pyridyl) 4-[2-(2-hydroxyethyl)pyrimidin-4-yl]-2,2-dimethyl-piperazine-1-carboxylate CAS Name: 4-[2-(2-hydroxyethyl)-4-pyrimidinyl]-2,2-dimethyl-1-piperazinecarboxylic acid (5-chloro-3-pyridinyl) ester IUPAC Name: (5-chloropyridin-3-yl) 4-[2-(2-hydroxyethyl)pyrimidin-4-yl]-2,2-dimethylpiperazine-1-carboxylate Traditional Name: 4-[2-(2-hydroxyethyl)pyrimidin-4-yl]-2,2-dimethyl-piperazine-1-carboxylic acid (5-chloro-3-pyridyl) ester Formula: C18H22ClN5O3 MolecularWeight: 391.85198

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(CCN1C(=O)OC2=CC(=CN=C2)Cl)C3=NC(=NC=C3)CCO)C

Isomeric SMILES

CC1(CN(CCN1C(=O)OC2=CC(=CN=C2)Cl)C3=NC(=NC=C3)CCO)C

InChI

InChI=1S/C18H22ClN5O3/c1-18(2)12-23(16-3-5-21-15(22-16)4-8-25)6-7-24(18)17(26)27-14-9-13(19)10-20-11-14/h3,5,9-11,25H,4,6-8,12H2,1-2H3