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

Systemtic Name: 2-[(3S)-3-methylpiperidin-1-yl]-5-nitro-6-pyrrolidin-1-yl-pyrimidin-4-amine Openeye Name: 2-[(3S)-3-methyl-1-piperidyl]-5-nitro-6-pyrrolidin-1-yl-pyrimidin-4-amine CAS Name: 2-[(3S)-3-methyl-1-piperidinyl]-5-nitro-6-(1-pyrrolidinyl)-4-pyrimidinamine IUPAC Name: 2-[(3S)-3-methylpiperidin-1-yl]-5-nitro-6-pyrrolidin-1-ylpyrimidin-4-amine Traditional Name: [2-[(3S)-3-methylpiperidino]-5-nitro-6-pyrrolidino-pyrimidin-4-yl]amine Formula: C14H22N6O2 MolecularWeight: 306.36348

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=NC(=C(C(=N2)N)[N+](=O)[O-])N3CCCC3

Isomeric SMILES

C[C@H]1CCCN(C1)C2=NC(=C(C(=N2)N)[N+](=O)[O-])N3CCCC3

InChI

InChI=1S/C14H22N6O2/c1-10-5-4-8-19(9-10)14-16-12(15)11(20(21)22)13(17-14)18-6-2-3-7-18/h10H,2-9H2,1H3,(H2,15,16,17)/t10-/m0/s1