N2-(3-methoxypropyl)-5-nitro-6-pyrrolidin-1-yl-pyrimidine-2,4-diamine

Systemtic Name: N2-(3-methoxypropyl)-5-nitro-6-pyrrolidin-1-yl-pyrimidine-2,4-diamine Openeye Name: N2-(3-methoxypropyl)-5-nitro-6-pyrrolidin-1-yl-pyrimidine-2,4-diamine CAS Name: N2-(3-methoxypropyl)-5-nitro-6-(1-pyrrolidinyl)pyrimidine-2,4-diamine IUPAC Name: 2-N-(3-methoxypropyl)-5-nitro-6-pyrrolidin-1-ylpyrimidine-2,4-diamine Traditional Name: (4-amino-5-nitro-6-pyrrolidino-pyrimidin-2-yl)-(3-methoxypropyl)amine Formula: C12H20N6O3 MolecularWeight: 296.3256

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC1=NC(=C(C(=N1)N)[N+](=O)[O-])N2CCCC2

Isomeric SMILES

COCCCNC1=NC(=C(C(=N1)N)[N+](=O)[O-])N2CCCC2

InChI

InChI=1S/C12H20N6O3/c1-21-8-4-5-14-12-15-10(13)9(18(19)20)11(16-12)17-6-2-3-7-17/h2-8H2,1H3,(H3,13,14,15,16)