N4-(furan-2-ylmethyl)-5-nitro-N2-prop-2-enyl-pyrimidine-2,4,6-triamine

Systemtic Name: N4-(furan-2-ylmethyl)-5-nitro-N2-prop-2-enyl-pyrimidine-2,4,6-triamine Openeye Name: N2-allyl-N4-(2-furylmethyl)-5-nitro-pyrimidine-2,4,6-triamine CAS Name: N4-(2-furanylmethyl)-5-nitro-N2-prop-2-enylpyrimidine-2,4,6-triamine IUPAC Name: 4-N-(furan-2-ylmethyl)-5-nitro-2-N-prop-2-enylpyrimidine-2,4,6-triamine Traditional Name: allyl-[4-amino-6-(2-furfurylamino)-5-nitro-pyrimidin-2-yl]amine Formula: C12H14N6O3 MolecularWeight: 290.27796

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=NC(=C(C(=N1)NCC2=CC=CO2)[N+](=O)[O-])N

Isomeric SMILES

C=CCNC1=NC(=C(C(=N1)NCC2=CC=CO2)[N+](=O)[O-])N

InChI

InChI=1S/C12H14N6O3/c1-2-5-14-12-16-10(13)9(18(19)20)11(17-12)15-7-8-4-3-6-21-8/h2-4,6H,1,5,7H2,(H4,13,14,15,16,17)