ethyl 2-[(6-ethyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-2-methyl-propanoate

Systemtic Name: ethyl 2-[(6-ethyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-2-methyl-propanoate Openeye Name: ethyl 2-[(6-ethyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-2-methyl-propanoate CAS Name: 2-[(6-ethyl-4-oxo-1H-pyrimidin-2-yl)thio]-2-methylpropanoic acid ethyl ester IUPAC Name: ethyl 2-[(6-ethyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-2-methylpropanoate Traditional Name: 2-[(6-ethyl-4-keto-1H-pyrimidin-2-yl)thio]-2-methyl-propionic acid ethyl ester Formula: C12H18N2O3S MolecularWeight: 270.34792

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)N=C(N1)SC(C)(C)C(=O)OCC

Isomeric SMILES

CCC1=CC(=O)N=C(N1)SC(C)(C)C(=O)OCC

InChI

InChI=1S/C12H18N2O3S/c1-5-8-7-9(15)14-11(13-8)18-12(3,4)10(16)17-6-2/h7H,5-6H2,1-4H3,(H,13,14,15)