N6-(5-chloranylpyridin-2-yl)-5-nitro-N4,N4-bis(phenylmethyl)pyrimidine-4,6-diamine

Systemtic Name: N6-(5-chloranylpyridin-2-yl)-5-nitro-N4,N4-bis(phenylmethyl)pyrimidine-4,6-diamine Openeye Name: N4,N4-dibenzyl-N6-(5-chloro-2-pyridyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-(5-chloro-2-pyridinyl)-5-nitro-N4,N4-bis(phenylmethyl)pyrimidine-4,6-diamine IUPAC Name: 4-N,4-N-dibenzyl-6-N-(5-chloropyridin-2-yl)-5-nitropyrimidine-4,6-diamine Traditional Name: dibenzyl-[6-[(5-chloro-2-pyridyl)amino]-5-nitro-pyrimidin-4-yl]amine Formula: C23H19ClN6O2 MolecularWeight: 446.88896

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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-])NC4=NC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C3=NC=NC(=C3[N+](=O)[O-])NC4=NC=C(C=C4)Cl

InChI

InChI=1S/C23H19ClN6O2/c24-19-11-12-20(25-13-19)28-22-21(30(31)32)23(27-16-26-22)29(14-17-7-3-1-4-8-17)15-18-9-5-2-6-10-18/h1-13,16H,14-15H2,(H,25,26,27,28)