methyl 2-[2-(3-methylbut-2-enylsulfanyl)-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate

Systemtic Name: methyl 2-[2-(3-methylbut-2-enylsulfanyl)-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[2-(3-methylbut-2-enylsulfanyl)-4-oxo-1H-pyrimidin-6-yl]acetate CAS Name: 2-[2-(3-methylbut-2-enylthio)-4-oxo-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(3-methylbut-2-enylsulfanyl)-4-oxo-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[4-keto-2-(3-methylbut-2-enylthio)-1H-pyrimidin-6-yl]acetic acid methyl ester Formula: C12H16N2O3S MolecularWeight: 268.33204

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCSC1=NC(=O)C=C(N1)CC(=O)OC)C

Isomeric SMILES

CC(=CCSC1=NC(=O)C=C(N1)CC(=O)OC)C

InChI

InChI=1S/C12H16N2O3S/c1-8(2)4-5-18-12-13-9(6-10(15)14-12)7-11(16)17-3/h4,6H,5,7H2,1-3H3,(H,13,14,15)