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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C2=C(C(=NC=N2)N(CC3=CC=CC=C3)C4=CC=CC=N4)[N+](=O)[O-]

Isomeric SMILES

CN(C1=CC=CC=C1)C2=C(C(=NC=N2)N(CC3=CC=CC=C3)C4=CC=CC=N4)[N+](=O)[O-]

InChI

InChI=1S/C23H20N6O2/c1-27(19-12-6-3-7-13-19)22-21(29(30)31)23(26-17-25-22)28(20-14-8-9-15-24-20)16-18-10-4-2-5-11-18/h2-15,17H,16H2,1H3