N6-(furan-2-ylmethyl)-5-nitro-N4-propan-2-yl-pyrimidine-4,6-diamine

Systemtic Name: N6-(furan-2-ylmethyl)-5-nitro-N4-propan-2-yl-pyrimidine-4,6-diamine Openeye Name: N6-(2-furylmethyl)-N4-isopropyl-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-(2-furanylmethyl)-5-nitro-N4-propan-2-ylpyrimidine-4,6-diamine IUPAC Name: 6-N-(furan-2-ylmethyl)-5-nitro-4-N-propan-2-ylpyrimidine-4,6-diamine Traditional Name: 2-furfuryl-[6-(isopropylamino)-5-nitro-pyrimidin-4-yl]amine Formula: C12H15N5O3 MolecularWeight: 277.2792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NC=NC(=C1[N+](=O)[O-])NCC2=CC=CO2

Isomeric SMILES

CC(C)NC1=NC=NC(=C1[N+](=O)[O-])NCC2=CC=CO2

InChI

InChI=1S/C12H15N5O3/c1-8(2)16-12-10(17(18)19)11(14-7-15-12)13-6-9-4-3-5-20-9/h3-5,7-8H,6H2,1-2H3,(H2,13,14,15,16)