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

Systemtic Name: N6,N6-dimethyl-5-nitro-N4-(phenylmethyl)-N4-pyridin-2-yl-pyrimidine-4,6-diamine Openeye Name: N4-benzyl-N6,N6-dimethyl-5-nitro-N4-(2-pyridyl)pyrimidine-4,6-diamine CAS Name: N6,N6-dimethyl-5-nitro-N4-(phenylmethyl)-N4-(2-pyridinyl)pyrimidine-4,6-diamine IUPAC Name: 4-N-benzyl-6-N,6-N-dimethyl-5-nitro-4-N-pyridin-2-ylpyrimidine-4,6-diamine Traditional Name: benzyl-[6-(dimethylamino)-5-nitro-pyrimidin-4-yl]-(2-pyridyl)amine Formula: C18H18N6O2 MolecularWeight: 350.37452

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC=NC(=C1[N+](=O)[O-])N(CC2=CC=CC=C2)C3=CC=CC=N3

Isomeric SMILES

CN(C)C1=NC=NC(=C1[N+](=O)[O-])N(CC2=CC=CC=C2)C3=CC=CC=N3

InChI

InChI=1S/C18H18N6O2/c1-22(2)17-16(24(25)26)18(21-13-20-17)23(15-10-6-7-11-19-15)12-14-8-4-3-5-9-14/h3-11,13H,12H2,1-2H3