N2-[3-(dimethylamino)propyl]-5-nitro-6-piperidin-1-yl-pyrimidine-2,4-diamine

Systemtic Name: N2-[3-(dimethylamino)propyl]-5-nitro-6-piperidin-1-yl-pyrimidine-2,4-diamine Openeye Name: N2-[3-(dimethylamino)propyl]-5-nitro-6-(1-piperidyl)pyrimidine-2,4-diamine CAS Name: N2-[3-(dimethylamino)propyl]-5-nitro-6-(1-piperidinyl)pyrimidine-2,4-diamine IUPAC Name: 2-N-[3-(dimethylamino)propyl]-5-nitro-6-piperidin-1-ylpyrimidine-2,4-diamine Traditional Name: 3-[(4-amino-5-nitro-6-piperidino-pyrimidin-2-yl)amino]propyl-dimethyl-amine Formula: C14H25N7O2 MolecularWeight: 323.394

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC1=NC(=C(C(=N1)N)[N+](=O)[O-])N2CCCCC2

Isomeric SMILES

CN(C)CCCNC1=NC(=C(C(=N1)N)[N+](=O)[O-])N2CCCCC2

InChI

InChI=1S/C14H25N7O2/c1-19(2)8-6-7-16-14-17-12(15)11(21(22)23)13(18-14)20-9-4-3-5-10-20/h3-10H2,1-2H3,(H3,15,16,17,18)