N6-(2-methylphenyl)-N4-(5-methylpyridin-2-yl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N6-(2-methylphenyl)-N4-(5-methylpyridin-2-yl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-(5-methyl-2-pyridyl)-5-nitro-N6-(o-tolyl)pyrimidine-4,6-diamine CAS Name: N6-(2-methylphenyl)-N4-(5-methyl-2-pyridinyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 6-N-(2-methylphenyl)-4-N-(5-methylpyridin-2-yl)-5-nitropyrimidine-4,6-diamine Traditional Name: (5-methyl-2-pyridyl)-[5-nitro-6-(o-toluidino)pyrimidin-4-yl]amine Formula: C17H16N6O2 MolecularWeight: 336.34794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)NC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC=C3C

Isomeric SMILES

CC1=CN=C(C=C1)NC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC=C3C

InChI

InChI=1S/C17H16N6O2/c1-11-7-8-14(18-9-11)22-17-15(23(24)25)16(19-10-20-17)21-13-6-4-3-5-12(13)2/h3-10H,1-2H3,(H2,18,19,20,21,22)