(4-fluorophenyl) 4-[(5-chloranyl-6-ethyl-pyrimidin-4-yl)amino]piperidine-1-carboxylate

Systemtic Name: (4-fluorophenyl) 4-[(5-chloranyl-6-ethyl-pyrimidin-4-yl)amino]piperidine-1-carboxylate Openeye Name: (4-fluorophenyl) 4-[(5-chloro-6-ethyl-pyrimidin-4-yl)amino]piperidine-1-carboxylate CAS Name: 4-[(5-chloro-6-ethyl-4-pyrimidinyl)amino]-1-piperidinecarboxylic acid (4-fluorophenyl) ester IUPAC Name: (4-fluorophenyl) 4-[(5-chloro-6-ethylpyrimidin-4-yl)amino]piperidine-1-carboxylate Traditional Name: 4-[(5-chloro-6-ethyl-pyrimidin-4-yl)amino]piperidine-1-carboxylic acid (4-fluorophenyl) ester Formula: C18H20ClFN4O2 MolecularWeight: 378.828403

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC=N1)NC2CCN(CC2)C(=O)OC3=CC=C(C=C3)F)Cl

Isomeric SMILES

CCC1=C(C(=NC=N1)NC2CCN(CC2)C(=O)OC3=CC=C(C=C3)F)Cl

InChI

InChI=1S/C18H20ClFN4O2/c1-2-15-16(19)17(22-11-21-15)23-13-7-9-24(10-8-13)18(25)26-14-5-3-12(20)4-6-14/h3-6,11,13H,2,7-10H2,1H3,(H,21,22,23)