tert-butyl 4-[(5-chloranyl-4-ethyl-pyrimidin-2-yl)amino]cyclohexane-1-carboxylate

Systemtic Name: tert-butyl 4-[(5-chloranyl-4-ethyl-pyrimidin-2-yl)amino]cyclohexane-1-carboxylate Openeye Name: tert-butyl 4-[(5-chloro-4-ethyl-pyrimidin-2-yl)amino]cyclohexanecarboxylate CAS Name: 4-[(5-chloro-4-ethyl-2-pyrimidinyl)amino]-1-cyclohexanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(5-chloro-4-ethylpyrimidin-2-yl)amino]cyclohexane-1-carboxylate Traditional Name: 4-[(5-chloro-4-ethyl-pyrimidin-2-yl)amino]cyclohexanecarboxylic acid tert-butyl ester Formula: C17H26ClN3O2 MolecularWeight: 339.86024

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=NC=C1Cl)NC2CCC(CC2)C(=O)OC(C)(C)C

Isomeric SMILES

CCC1=NC(=NC=C1Cl)NC2CCC(CC2)C(=O)OC(C)(C)C

InChI

InChI=1S/C17H26ClN3O2/c1-5-14-13(18)10-19-16(21-14)20-12-8-6-11(7-9-12)15(22)23-17(2,3)4/h10-12H,5-9H2,1-4H3,(H,19,20,21)