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

Systemtic Name: N6-(furan-2-ylmethyl)-5-nitro-N4,N4-bis(phenylmethyl)pyrimidine-4,6-diamine Openeye Name: N4,N4-dibenzyl-N6-(2-furylmethyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-(2-furanylmethyl)-5-nitro-N4,N4-bis(phenylmethyl)pyrimidine-4,6-diamine IUPAC Name: 4-N,4-N-dibenzyl-6-N-(furan-2-ylmethyl)-5-nitropyrimidine-4,6-diamine Traditional Name: dibenzyl-[6-(2-furfurylamino)-5-nitro-pyrimidin-4-yl]amine Formula: C23H21N5O3 MolecularWeight: 415.44454

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C3=NC=NC(=C3[N+](=O)[O-])NCC4=CC=CO4

Isomeric SMILES

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C3=NC=NC(=C3[N+](=O)[O-])NCC4=CC=CO4

InChI

InChI=1S/C23H21N5O3/c29-28(30)21-22(24-14-20-12-7-13-31-20)25-17-26-23(21)27(15-18-8-3-1-4-9-18)16-19-10-5-2-6-11-19/h1-13,17H,14-16H2,(H,24,25,26)