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

Systemtic Name: 2-[(3S)-3-methylpiperidin-1-yl]-6-morpholin-4-yl-5-nitro-pyrimidin-4-amine Openeye Name: 2-[(3S)-3-methyl-1-piperidyl]-6-morpholino-5-nitro-pyrimidin-4-amine CAS Name: 2-[(3S)-3-methyl-1-piperidinyl]-6-(4-morpholinyl)-5-nitro-4-pyrimidinamine IUPAC Name: 2-[(3S)-3-methylpiperidin-1-yl]-6-morpholin-4-yl-5-nitropyrimidin-4-amine Traditional Name: [2-[(3S)-3-methylpiperidino]-6-morpholino-5-nitro-pyrimidin-4-yl]amine Formula: C14H22N6O3 MolecularWeight: 322.36288

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=NC(=C(C(=N2)N)[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

C[C@H]1CCCN(C1)C2=NC(=C(C(=N2)N)[N+](=O)[O-])N3CCOCC3

InChI

InChI=1S/C14H22N6O3/c1-10-3-2-4-19(9-10)14-16-12(15)11(20(21)22)13(17-14)18-5-7-23-8-6-18/h10H,2-9H2,1H3,(H2,15,16,17)/t10-/m0/s1