[(2S)-1-(dimethylamino)-1-oxidanylidene-propan-2-yl] 2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoate

Systemtic Name: [(2S)-1-(dimethylamino)-1-oxidanylidene-propan-2-yl] 2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoate Openeye Name: [(1S)-2-(dimethylamino)-1-methyl-2-oxo-ethyl] 2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetate CAS Name: 2-(4-thieno[2,3-d]pyrimidinylthio)acetic acid [(2S)-1-(dimethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(dimethylamino)-1-oxopropan-2-yl] 2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetate Traditional Name: 2-(thieno[2,3-d]pyrimidin-4-ylthio)acetic acid [(1S)-2-(dimethylamino)-2-keto-1-methyl-ethyl] ester Formula: C13H15N3O3S2 MolecularWeight: 325.4065

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)C)OC(=O)CSC1=NC=NC2=C1C=CS2

Isomeric SMILES

C[C@@H](C(=O)N(C)C)OC(=O)CSC1=NC=NC2=C1C=CS2

InChI

InChI=1S/C13H15N3O3S2/c1-8(13(18)16(2)3)19-10(17)6-21-12-9-4-5-20-11(9)14-7-15-12/h4-5,7-8H,6H2,1-3H3/t8-/m0/s1