5-nitro-N4-[[(2R)-oxolan-2-yl]methyl]-2-pyrrolidin-1-yl-pyrimidine-4,6-diamine

Systemtic Name: 5-nitro-N4-[[(2R)-oxolan-2-yl]methyl]-2-pyrrolidin-1-yl-pyrimidine-4,6-diamine Openeye Name: 5-nitro-2-pyrrolidin-1-yl-N4-[[(2R)-tetrahydrofuran-2-yl]methyl]pyrimidine-4,6-diamine CAS Name: 5-nitro-N4-[[(2R)-2-oxolanyl]methyl]-2-(1-pyrrolidinyl)pyrimidine-4,6-diamine IUPAC Name: 5-nitro-4-N-[[(2R)-oxolan-2-yl]methyl]-2-pyrrolidin-1-ylpyrimidine-4,6-diamine Traditional Name: (6-amino-5-nitro-2-pyrrolidino-pyrimidin-4-yl)-[[(2R)-tetrahydrofuran-2-yl]methyl]amine Formula: C13H20N6O3 MolecularWeight: 308.3363

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC(=C(C(=N2)NCC3CCCO3)[N+](=O)[O-])N

Isomeric SMILES

C1CCN(C1)C2=NC(=C(C(=N2)NC[C@H]3CCCO3)[N+](=O)[O-])N

InChI

InChI=1S/C13H20N6O3/c14-11-10(19(20)21)12(15-8-9-4-3-7-22-9)17-13(16-11)18-5-1-2-6-18/h9H,1-8H2,(H3,14,15,16,17)/t9-/m1/s1