(2R)-2-(2,5,6-trimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)butanoate

Systemtic Name: (2R)-2-(2,5,6-trimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)butanoate Openeye Name: (2R)-2-(2,5,6-trimethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)butanoate CAS Name: (2R)-2-(2,5,6-trimethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)butanoate IUPAC Name: (2R)-2-(2,5,6-trimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)butanoate Traditional Name: (2R)-2-(4-keto-2,5,6-trimethyl-thieno[2,3-d]pyrimidin-3-yl)butyrate Formula: C13H15N2O3S- MolecularWeight: 279.3348

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)[O-])N1C(=NC2=C(C1=O)C(=C(S2)C)C)C

Isomeric SMILES

CC[C@H](C(=O)[O-])N1C(=NC2=C(C1=O)C(=C(S2)C)C)C

InChI

InChI=1S/C13H16N2O3S/c1-5-9(13(17)18)15-8(4)14-11-10(12(15)16)6(2)7(3)19-11/h9H,5H2,1-4H3,(H,17,18)/p-1/t9-/m1/s1