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

Systemtic Name: 2-[3-(3-methoxypropyl)-4-oxidanylidene-thieno[3,2-d]pyrimidin-2-yl]sulfanylethanoic acid Openeye Name: 2-[3-(3-methoxypropyl)-4-oxo-thieno[3,2-d]pyrimidin-2-yl]sulfanylacetic acid CAS Name: 2-[[3-(3-methoxypropyl)-4-oxo-2-thieno[3,2-d]pyrimidinyl]thio]acetic acid IUPAC Name: 2-[3-(3-methoxypropyl)-4-oxothieno[3,2-d]pyrimidin-2-yl]sulfanylacetic acid Traditional Name: 2-[[4-keto-3-(3-methoxypropyl)thieno[3,2-d]pyrimidin-2-yl]thio]acetic acid Formula: C12H14N2O4S2 MolecularWeight: 314.38056

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)C2=C(C=CS2)N=C1SCC(=O)O

Isomeric SMILES

COCCCN1C(=O)C2=C(C=CS2)N=C1SCC(=O)O

InChI

InChI=1S/C12H14N2O4S2/c1-18-5-2-4-14-11(17)10-8(3-6-19-10)13-12(14)20-7-9(15)16/h3,6H,2,4-5,7H2,1H3,(H,15,16)