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

Systemtic Name: N2-(furan-2-ylmethyl)-5-nitro-N4-(phenylmethyl)pyrimidine-2,4,6-triamine Openeye Name: N4-benzyl-N2-(2-furylmethyl)-5-nitro-pyrimidine-2,4,6-triamine CAS Name: N2-(2-furanylmethyl)-5-nitro-N4-(phenylmethyl)pyrimidine-2,4,6-triamine IUPAC Name: 4-N-benzyl-2-N-(furan-2-ylmethyl)-5-nitropyrimidine-2,4,6-triamine Traditional Name: [4-amino-6-(benzylamino)-5-nitro-pyrimidin-2-yl]-(2-furfuryl)amine Formula: C16H16N6O3 MolecularWeight: 340.33664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC(=NC(=C2[N+](=O)[O-])N)NCC3=CC=CO3

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC(=NC(=C2[N+](=O)[O-])N)NCC3=CC=CO3

InChI

InChI=1S/C16H16N6O3/c17-14-13(22(23)24)15(18-9-11-5-2-1-3-6-11)21-16(20-14)19-10-12-7-4-8-25-12/h1-8H,9-10H2,(H4,17,18,19,20,21)