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

Systemtic Name: N4-(furan-2-ylmethyl)-5-nitro-N6-(phenylmethyl)pyrimidine-4,6-diamine Openeye Name: N6-benzyl-N4-(2-furylmethyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-(2-furanylmethyl)-5-nitro-N6-(phenylmethyl)pyrimidine-4,6-diamine IUPAC Name: 6-N-benzyl-4-N-(furan-2-ylmethyl)-5-nitropyrimidine-4,6-diamine Traditional Name: benzyl-[6-(2-furfurylamino)-5-nitro-pyrimidin-4-yl]amine Formula: C16H15N5O3 MolecularWeight: 325.322

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C(=NC=N2)NCC3=CC=CO3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C(=NC=N2)NCC3=CC=CO3)[N+](=O)[O-]

InChI

InChI=1S/C16H15N5O3/c22-21(23)14-15(17-9-12-5-2-1-3-6-12)19-11-20-16(14)18-10-13-7-4-8-24-13/h1-8,11H,9-10H2,(H2,17,18,19,20)