ethyl 2-[6-[3-(dimethylcarbamoyl)-5-methyl-phenoxy]-2-methylsulfanyl-5-nitro-pyrimidin-4-yl]oxyethanoate

Systemtic Name: ethyl 2-[6-[3-(dimethylcarbamoyl)-5-methyl-phenoxy]-2-methylsulfanyl-5-nitro-pyrimidin-4-yl]oxyethanoate Openeye Name: ethyl 2-[6-[3-(dimethylcarbamoyl)-5-methyl-phenoxy]-2-methylsulfanyl-5-nitro-pyrimidin-4-yl]oxyacetate CAS Name: 2-[[6-[3-[dimethylamino(oxo)methyl]-5-methylphenoxy]-2-(methylthio)-5-nitro-4-pyrimidinyl]oxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-[3-(dimethylcarbamoyl)-5-methylphenoxy]-2-methylsulfanyl-5-nitropyrimidin-4-yl]oxyacetate Traditional Name: 2-[6-[3-(dimethylcarbamoyl)-5-methyl-phenoxy]-2-(methylthio)-5-nitro-pyrimidin-4-yl]oxyacetic acid ethyl ester Formula: C19H22N4O7S MolecularWeight: 450.46558

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=NC(=NC(=C1[N+](=O)[O-])OC2=CC(=CC(=C2)C)C(=O)N(C)C)SC

Isomeric SMILES

CCOC(=O)COC1=NC(=NC(=C1[N+](=O)[O-])OC2=CC(=CC(=C2)C)C(=O)N(C)C)SC

InChI

InChI=1S/C19H22N4O7S/c1-6-28-14(24)10-29-16-15(23(26)27)17(21-19(20-16)31-5)30-13-8-11(2)7-12(9-13)18(25)22(3)4/h7-9H,6,10H2,1-5H3