2-[3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]sulfanylethanoic acid

Systemtic Name: 2-[3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]sulfanylethanoic acid Openeye Name: 2-[3-(2-amino-2-oxo-ethyl)-4-oxo-thieno[2,3-d]pyrimidin-2-yl]sulfanylacetic acid CAS Name: 2-[[3-(2-amino-2-oxoethyl)-4-oxo-2-thieno[2,3-d]pyrimidinyl]thio]acetic acid IUPAC Name: 2-[3-(2-amino-2-oxoethyl)-4-oxothieno[2,3-d]pyrimidin-2-yl]sulfanylacetic acid Traditional Name: 2-[[3-(2-amino-2-keto-ethyl)-4-keto-thieno[2,3-d]pyrimidin-2-yl]thio]acetic acid Formula: C10H9N3O4S2 MolecularWeight: 299.32616

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC2=C1C(=O)N(C(=N2)SCC(=O)O)CC(=O)N

Isomeric SMILES

C1=CSC2=C1C(=O)N(C(=N2)SCC(=O)O)CC(=O)N

InChI

InChI=1S/C10H9N3O4S2/c11-6(14)3-13-9(17)5-1-2-18-8(5)12-10(13)19-4-7(15)16/h1-2H,3-4H2,(H2,11,14)(H,15,16)