N4-(5-methylpyridin-2-yl)-5-nitro-N6-(3-nitrophenyl)pyrimidine-4,6-diamine

Systemtic Name: N4-(5-methylpyridin-2-yl)-5-nitro-N6-(3-nitrophenyl)pyrimidine-4,6-diamine Openeye Name: N4-(5-methyl-2-pyridyl)-5-nitro-N6-(3-nitrophenyl)pyrimidine-4,6-diamine CAS Name: N4-(5-methyl-2-pyridinyl)-5-nitro-N6-(3-nitrophenyl)pyrimidine-4,6-diamine IUPAC Name: 4-N-(5-methylpyridin-2-yl)-5-nitro-6-N-(3-nitrophenyl)pyrimidine-4,6-diamine Traditional Name: (5-methyl-2-pyridyl)-[5-nitro-6-(3-nitroanilino)pyrimidin-4-yl]amine Formula: C16H13N7O4 MolecularWeight: 367.31892

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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=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CN=C(C=C1)NC2=NC=NC(=C2[N+](=O)[O-])NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H13N7O4/c1-10-5-6-13(17-8-10)21-16-14(23(26)27)15(18-9-19-16)20-11-3-2-4-12(7-11)22(24)25/h2-9H,1H3,(H2,17,18,19,20,21)