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

Systemtic Name: N4-(furan-2-ylmethyl)-N6-(3-morpholin-4-ylpropyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-(2-furylmethyl)-N6-(3-morpholinopropyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-(2-furanylmethyl)-N6-[3-(4-morpholinyl)propyl]-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-(furan-2-ylmethyl)-6-N-(3-morpholin-4-ylpropyl)-5-nitropyrimidine-4,6-diamine Traditional Name: 2-furfuryl-[6-(3-morpholinopropylamino)-5-nitro-pyrimidin-4-yl]amine Formula: C16H22N6O4 MolecularWeight: 362.38368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC2=NC=NC(=C2[N+](=O)[O-])NCC3=CC=CO3

Isomeric SMILES

C1COCCN1CCCNC2=NC=NC(=C2[N+](=O)[O-])NCC3=CC=CO3

InChI

InChI=1S/C16H22N6O4/c23-22(24)14-15(17-4-2-5-21-6-9-25-10-7-21)19-12-20-16(14)18-11-13-3-1-8-26-13/h1,3,8,12H,2,4-7,9-11H2,(H2,17,18,19,20)