6-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-(4-methylpiperidin-1-yl)-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-(4-methylpiperidin-1-yl)-5-nitro-pyrimidin-4-amine Openeye Name: 6-[(3R,5R)-3,5-dimethyl-1-piperidyl]-2-(4-methyl-1-piperidyl)-5-nitro-pyrimidin-4-amine CAS Name: 6-[(3R,5R)-3,5-dimethyl-1-piperidinyl]-2-(4-methyl-1-piperidinyl)-5-nitro-4-pyrimidinamine IUPAC Name: 6-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-(4-methylpiperidin-1-yl)-5-nitropyrimidin-4-amine Traditional Name: [6-[(3R,5R)-3,5-dimethylpiperidino]-2-(4-methylpiperidino)-5-nitro-pyrimidin-4-yl]amine Formula: C17H28N6O2 MolecularWeight: 348.44322

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=NC(=C(C(=N2)N)[N+](=O)[O-])N3CC(CC(C3)C)C

Isomeric SMILES

C[C@@H]1C[C@H](CN(C1)C2=C(C(=NC(=N2)N3CCC(CC3)C)N)[N+](=O)[O-])C

InChI

InChI=1S/C17H28N6O2/c1-11-4-6-21(7-5-11)17-19-15(18)14(23(24)25)16(20-17)22-9-12(2)8-13(3)10-22/h11-13H,4-10H2,1-3H3,(H2,18,19,20)/t12-,13-/m1/s1