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

Systemtic Name: [(2S)-1-oxidanylidene-1-(propan-2-ylamino)propan-2-yl] 2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoate Openeye Name: [(1S)-2-(isopropylamino)-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-oxo-1-(propan-2-ylamino)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(propan-2-ylamino)propan-2-yl] 2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetate Traditional Name: 2-(thieno[2,3-d]pyrimidin-4-ylthio)acetic acid [(1S)-2-(isopropylamino)-2-keto-1-methyl-ethyl] ester Formula: C14H17N3O3S2 MolecularWeight: 339.43308

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N3O3S2/c1-8(2)17-12(19)9(3)20-11(18)6-22-14-10-4-5-21-13(10)15-7-16-14/h4-5,7-9H,6H2,1-3H3,(H,17,19)/t9-/m0/s1