[(2R)-1-azanyl-1-oxidanylidene-propan-2-yl] 2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanoate

Systemtic Name: [(2R)-1-azanyl-1-oxidanylidene-propan-2-yl] 2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanoate Openeye Name: [(1R)-2-amino-1-methyl-2-oxo-ethyl] 2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetate CAS Name: 2-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)thio]acetic acid [(2R)-1-amino-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-amino-1-oxopropan-2-yl] 2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetate Traditional Name: 2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]acetic acid [(1R)-2-amino-2-keto-1-methyl-ethyl] ester Formula: C13H15N3O3S2 MolecularWeight: 325.4065

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NC=N2)SCC(=O)OC(C)C(=O)N)C

Isomeric SMILES

CC1=C(SC2=C1C(=NC=N2)SCC(=O)O[C@H](C)C(=O)N)C

InChI

InChI=1S/C13H15N3O3S2/c1-6-8(3)21-13-10(6)12(15-5-16-13)20-4-9(17)19-7(2)11(14)18/h5,7H,4H2,1-3H3,(H2,14,18)/t7-/m1/s1