methyl 6-[(4-tert-butylcyclohexyl)amino]-5-chloranyl-pyrimidine-4-carboxylate

Systemtic Name: methyl 6-[(4-tert-butylcyclohexyl)amino]-5-chloranyl-pyrimidine-4-carboxylate Openeye Name: methyl 6-[(4-tert-butylcyclohexyl)amino]-5-chloro-pyrimidine-4-carboxylate CAS Name: 6-[(4-tert-butylcyclohexyl)amino]-5-chloro-4-pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 6-[(4-tert-butylcyclohexyl)amino]-5-chloropyrimidine-4-carboxylate Traditional Name: 6-[(4-tert-butylcyclohexyl)amino]-5-chloro-pyrimidine-4-carboxylic acid methyl ester Formula: C16H24ClN3O2 MolecularWeight: 325.83366

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)NC2=NC=NC(=C2Cl)C(=O)OC

Isomeric SMILES

CC(C)(C)C1CCC(CC1)NC2=NC=NC(=C2Cl)C(=O)OC

InChI

InChI=1S/C16H24ClN3O2/c1-16(2,3)10-5-7-11(8-6-10)20-14-12(17)13(15(21)22-4)18-9-19-14/h9-11H,5-8H2,1-4H3,(H,18,19,20)