5-nitro-N4,N4-bis(phenylmethyl)-N6-pyridin-3-yl-pyrimidine-4,6-diamine

Systemtic Name: 5-nitro-N4,N4-bis(phenylmethyl)-N6-pyridin-3-yl-pyrimidine-4,6-diamine Openeye Name: N4,N4-dibenzyl-5-nitro-N6-(3-pyridyl)pyrimidine-4,6-diamine CAS Name: 5-nitro-N4,N4-bis(phenylmethyl)-N6-(3-pyridinyl)pyrimidine-4,6-diamine IUPAC Name: 4-N,4-N-dibenzyl-5-nitro-6-N-pyridin-3-ylpyrimidine-4,6-diamine Traditional Name: dibenzyl-[5-nitro-6-(3-pyridylamino)pyrimidin-4-yl]amine Formula: C23H20N6O2 MolecularWeight: 412.4439

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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=CN=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C23H20N6O2/c30-29(31)21-22(27-20-12-7-13-24-14-20)25-17-26-23(21)28(15-18-8-3-1-4-9-18)16-19-10-5-2-6-11-19/h1-14,17H,15-16H2,(H,25,26,27)