tert-butyl (3R)-3-[(5-azanyl-6-chloranyl-pyrimidin-4-yl)amino]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (3R)-3-[(5-azanyl-6-chloranyl-pyrimidin-4-yl)amino]pyrrolidine-1-carboxylate Openeye Name: tert-butyl (3R)-3-[(5-amino-6-chloro-pyrimidin-4-yl)amino]pyrrolidine-1-carboxylate CAS Name: (3R)-3-[(5-amino-6-chloro-4-pyrimidinyl)amino]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3R)-3-[(5-amino-6-chloropyrimidin-4-yl)amino]pyrrolidine-1-carboxylate Traditional Name: (3R)-3-[(5-amino-6-chloro-pyrimidin-4-yl)amino]pyrrolidine-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)N1CCC(C1)NC2=C(C(=NC=N2)Cl)N

Isomeric SMILES

CC(C)(C)OC(=O)N1CC[C@H](C1)NC2=C(C(=NC=N2)Cl)N

InChI

InChI=1S/C13H20ClN5O2/c1-13(2,3)21-12(20)19-5-4-8(6-19)18-11-9(15)10(14)16-7-17-11/h7-8H,4-6,15H2,1-3H3,(H,16,17,18)/t8-/m1/s1