methyl 2-[2-[2-(3,5-dimethylphenoxy)ethylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate

Systemtic Name: methyl 2-[2-[2-(3,5-dimethylphenoxy)ethylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[2-[2-(3,5-dimethylphenoxy)ethylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]acetate CAS Name: 2-[2-[2-(3,5-dimethylphenoxy)ethylthio]-4-oxo-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[2-(3,5-dimethylphenoxy)ethylsulfanyl]-4-oxo-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[2-[2-(3,5-dimethylphenoxy)ethylthio]-4-keto-1H-pyrimidin-6-yl]acetic acid methyl ester Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCSC2=NC(=O)C=C(N2)CC(=O)OC)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCSC2=NC(=O)C=C(N2)CC(=O)OC)C

InChI

InChI=1S/C17H20N2O4S/c1-11-6-12(2)8-14(7-11)23-4-5-24-17-18-13(9-15(20)19-17)10-16(21)22-3/h6-9H,4-5,10H2,1-3H3,(H,18,19,20)