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

Systemtic Name: N6-(furan-2-ylmethyl)-5-nitro-N4-quinolin-5-yl-pyrimidine-4,6-diamine Openeye Name: N6-(2-furylmethyl)-5-nitro-N4-(5-quinolyl)pyrimidine-4,6-diamine CAS Name: N6-(2-furanylmethyl)-5-nitro-N4-(5-quinolinyl)pyrimidine-4,6-diamine IUPAC Name: 6-N-(furan-2-ylmethyl)-5-nitro-4-N-quinolin-5-ylpyrimidine-4,6-diamine Traditional Name: 2-furfuryl-[5-nitro-6-(5-quinolylamino)pyrimidin-4-yl]amine Formula: C18H14N6O3 MolecularWeight: 362.34216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC=N2)C(=C1)NC3=C(C(=NC=N3)NCC4=CC=CO4)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=CC=N2)C(=C1)NC3=C(C(=NC=N3)NCC4=CC=CO4)[N+](=O)[O-]

InChI

InChI=1S/C18H14N6O3/c25-24(26)16-17(20-10-12-4-3-9-27-12)21-11-22-18(16)23-15-7-1-6-14-13(15)5-2-8-19-14/h1-9,11H,10H2,(H2,20,21,22,23)