N2-[(2-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-5-nitro-pyrimidine-2,4-diamine

Systemtic Name: N2-[(2-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-5-nitro-pyrimidine-2,4-diamine Openeye Name: N2-[(2-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-5-nitro-pyrimidine-2,4-diamine CAS Name: N2-[(2-methoxyphenyl)-(1-methyl-2-imidazolyl)methyl]-5-nitropyrimidine-2,4-diamine IUPAC Name: 2-N-[(2-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-5-nitropyrimidine-2,4-diamine Traditional Name: (4-amino-5-nitro-pyrimidin-2-yl)-[(2-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]amine Formula: C16H17N7O3 MolecularWeight: 355.35128

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(C2=CC=CC=C2OC)NC3=NC=C(C(=N3)N)[N+](=O)[O-]

Isomeric SMILES

CN1C=CN=C1C(C2=CC=CC=C2OC)NC3=NC=C(C(=N3)N)[N+](=O)[O-]

InChI

InChI=1S/C16H17N7O3/c1-22-8-7-18-15(22)13(10-5-3-4-6-12(10)26-2)20-16-19-9-11(23(24)25)14(17)21-16/h3-9,13H,1-2H3,(H3,17,19,20,21)