tert-butyl 4-(2-azanyl-6-chloranyl-pyrimidin-4-yl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(2-azanyl-6-chloranyl-pyrimidin-4-yl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(2-amino-6-chloro-pyrimidin-4-yl)piperazine-1-carboxylate CAS Name: 4-(2-amino-6-chloro-4-pyrimidinyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2-amino-6-chloropyrimidin-4-yl)piperazine-1-carboxylate Traditional Name: 4-(2-amino-6-chloro-pyrimidin-4-yl)piperazine-1-carboxylic acid tert-butyl ester Formula: C13H20ClN5O2 MolecularWeight: 313.7832

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20ClN5O2/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,(H2,15,16,17)