tert-butyl N-[3-[(5-azanyl-2-chloranyl-6-methyl-pyrimidin-4-yl)amino]propyl]carbamate

Systemtic Name: tert-butyl N-[3-[(5-azanyl-2-chloranyl-6-methyl-pyrimidin-4-yl)amino]propyl]carbamate Openeye Name: tert-butyl N-[3-[(5-amino-2-chloro-6-methyl-pyrimidin-4-yl)amino]propyl]carbamate CAS Name: N-[3-[(5-amino-2-chloro-6-methyl-4-pyrimidinyl)amino]propyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[(5-amino-2-chloro-6-methylpyrimidin-4-yl)amino]propyl]carbamate Traditional Name: N-[3-[(5-amino-2-chloro-6-methyl-pyrimidin-4-yl)amino]propyl]carbamic acid tert-butyl ester Formula: C13H22ClN5O2 MolecularWeight: 315.79908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)Cl)NCCCNC(=O)OC(C)(C)C)N

Isomeric SMILES

CC1=C(C(=NC(=N1)Cl)NCCCNC(=O)OC(C)(C)C)N

InChI

InChI=1S/C13H22ClN5O2/c1-8-9(15)10(19-11(14)18-8)16-6-5-7-17-12(20)21-13(2,3)4/h5-7,15H2,1-4H3,(H,17,20)(H,16,18,19)