ethyl 4-(4-ethyl-1-methyl-6-oxidanylidene-pyrimidin-2-yl)sulfanylbutanoate

Systemtic Name: ethyl 4-(4-ethyl-1-methyl-6-oxidanylidene-pyrimidin-2-yl)sulfanylbutanoate Openeye Name: ethyl 4-(4-ethyl-1-methyl-6-oxo-pyrimidin-2-yl)sulfanylbutanoate CAS Name: 4-[(4-ethyl-1-methyl-6-oxo-2-pyrimidinyl)thio]butanoic acid ethyl ester IUPAC Name: ethyl 4-(4-ethyl-1-methyl-6-oxopyrimidin-2-yl)sulfanylbutanoate Traditional Name: 4-[(4-ethyl-6-keto-1-methyl-pyrimidin-2-yl)thio]butyric acid ethyl ester Formula: C13H20N2O3S MolecularWeight: 284.3745

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N2O3S/c1-4-10-9-11(16)15(3)13(14-10)19-8-6-7-12(17)18-5-2/h9H,4-8H2,1-3H3