N4-(furan-2-ylmethyl)-N6-(3-methoxypropyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-(furan-2-ylmethyl)-N6-(3-methoxypropyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-(2-furylmethyl)-N6-(3-methoxypropyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-(2-furanylmethyl)-N6-(3-methoxypropyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-(furan-2-ylmethyl)-6-N-(3-methoxypropyl)-5-nitropyrimidine-4,6-diamine Traditional Name: 2-furfuryl-[6-(3-methoxypropylamino)-5-nitro-pyrimidin-4-yl]amine Formula: C13H17N5O4 MolecularWeight: 307.30518

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC1=NC=NC(=C1[N+](=O)[O-])NCC2=CC=CO2

Isomeric SMILES

COCCCNC1=NC=NC(=C1[N+](=O)[O-])NCC2=CC=CO2

InChI

InChI=1S/C13H17N5O4/c1-21-6-3-5-14-12-11(18(19)20)13(17-9-16-12)15-8-10-4-2-7-22-10/h2,4,7,9H,3,5-6,8H2,1H3,(H2,14,15,16,17)