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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C(=NC(=N2)N3CC(CC(C3)C)C)N)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CCCN(C1)C2=C(C(=NC(=N2)N3C[C@@H](C[C@@H](C3)C)C)N)[N+](=O)[O-]

InChI

InChI=1S/C17H28N6O2/c1-11-5-4-6-21(8-11)16-14(23(24)25)15(18)19-17(20-16)22-9-12(2)7-13(3)10-22/h11-13H,4-10H2,1-3H3,(H2,18,19,20)/t11-,12-,13+/m0/s1