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

Systemtic Name: 5-nitro-N4,N6-bis(phenylmethyl)-N4-pyridin-2-yl-pyrimidine-4,6-diamine Openeye Name: N4,N6-dibenzyl-5-nitro-N4-(2-pyridyl)pyrimidine-4,6-diamine CAS Name: 5-nitro-N4,N6-bis(phenylmethyl)-N4-(2-pyridinyl)pyrimidine-4,6-diamine IUPAC Name: 4-N,6-N-dibenzyl-5-nitro-4-N-pyridin-2-ylpyrimidine-4,6-diamine Traditional Name: benzyl-[6-(benzylamino)-5-nitro-pyrimidin-4-yl]-(2-pyridyl)amine Formula: C23H20N6O2 MolecularWeight: 412.4439

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=C(C(=NC=N2)N(CC3=CC=CC=C3)C4=CC=CC=N4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC2=C(C(=NC=N2)N(CC3=CC=CC=C3)C4=CC=CC=N4)[N+](=O)[O-]

InChI

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