(2R)-2-(6-methyl-2-methylsulfanyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)butanoate

Systemtic Name: (2R)-2-(6-methyl-2-methylsulfanyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)butanoate Openeye Name: (2R)-2-(6-methyl-2-methylsulfanyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)butanoate CAS Name: (2R)-2-[6-methyl-2-(methylthio)-4-oxo-3-thieno[2,3-d]pyrimidinyl]butanoate IUPAC Name: (2R)-2-(6-methyl-2-methylsulfanyl-4-oxothieno[2,3-d]pyrimidin-3-yl)butanoate Traditional Name: (2R)-2-[4-keto-6-methyl-2-(methylthio)thieno[2,3-d]pyrimidin-3-yl]butyrate Formula: C12H13N2O3S2- MolecularWeight: 297.37322

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)[O-])N1C(=O)C2=C(N=C1SC)SC(=C2)C

Isomeric SMILES

CC[C@H](C(=O)[O-])N1C(=O)C2=C(N=C1SC)SC(=C2)C

InChI

InChI=1S/C12H14N2O3S2/c1-4-8(11(16)17)14-10(15)7-5-6(2)19-9(7)13-12(14)18-3/h5,8H,4H2,1-3H3,(H,16,17)/p-1/t8-/m1/s1