3-[4-azanyl-6-(4-cyano-3-methyl-phenoxy)-5-nitro-pyrimidin-2-yl]oxy-N,N-dimethyl-benzamide

Systemtic Name: 3-[4-azanyl-6-(4-cyano-3-methyl-phenoxy)-5-nitro-pyrimidin-2-yl]oxy-N,N-dimethyl-benzamide Openeye Name: 3-[4-amino-6-(4-cyano-3-methyl-phenoxy)-5-nitro-pyrimidin-2-yl]oxy-N,N-dimethyl-benzamide CAS Name: 3-[[4-amino-6-(4-cyano-3-methylphenoxy)-5-nitro-2-pyrimidinyl]oxy]-N,N-dimethylbenzamide IUPAC Name: 3-[4-amino-6-(4-cyano-3-methylphenoxy)-5-nitropyrimidin-2-yl]oxy-N,N-dimethylbenzamide Traditional Name: 3-[4-amino-6-(4-cyano-3-methyl-phenoxy)-5-nitro-pyrimidin-2-yl]oxy-N,N-dimethyl-benzamide Formula: C21H18N6O5 MolecularWeight: 434.40482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=NC(=NC(=C2[N+](=O)[O-])N)OC3=CC=CC(=C3)C(=O)N(C)C)C#N

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=NC(=NC(=C2[N+](=O)[O-])N)OC3=CC=CC(=C3)C(=O)N(C)C)C#N

InChI

InChI=1S/C21H18N6O5/c1-12-9-16(8-7-14(12)11-22)31-19-17(27(29)30)18(23)24-21(25-19)32-15-6-4-5-13(10-15)20(28)26(2)3/h4-10H,1-3H3,(H2,23,24,25)