tert-butyl 4-[2,6-bis(azanyl)pyrimidin-4-yl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2,6-bis(azanyl)pyrimidin-4-yl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-(2,6-diaminopyrimidin-4-yl)piperazine-1-carboxylate CAS Name: 4-(2,6-diamino-4-pyrimidinyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2,6-diaminopyrimidin-4-yl)piperazine-1-carboxylate Traditional Name: 4-(2,6-diaminopyrimidin-4-yl)piperazine-1-carboxylic acid tert-butyl ester Formula: C13H22N6O2 MolecularWeight: 294.35278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC(=NC(=N2)N)N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC(=NC(=N2)N)N

InChI

InChI=1S/C13H22N6O2/c1-13(2,3)21-12(20)19-6-4-18(5-7-19)10-8-9(14)16-11(15)17-10/h8H,4-7H2,1-3H3,(H4,14,15,16,17)