6-[2-(carboxymethylsulfanyl)-4-oxidanylidene-thieno[3,2-d]pyrimidin-3-yl]hexanoic acid

Systemtic Name: 6-[2-(carboxymethylsulfanyl)-4-oxidanylidene-thieno[3,2-d]pyrimidin-3-yl]hexanoic acid Openeye Name: 6-[2-(carboxymethylsulfanyl)-4-oxo-thieno[3,2-d]pyrimidin-3-yl]hexanoic acid CAS Name: 6-[2-(carboxymethylthio)-4-oxo-3-thieno[3,2-d]pyrimidinyl]hexanoic acid IUPAC Name: 6-[2-(carboxymethylsulfanyl)-4-oxothieno[3,2-d]pyrimidin-3-yl]hexanoic acid Traditional Name: 6-[2-(carboxymethylthio)-4-keto-thieno[3,2-d]pyrimidin-3-yl]hexanoic acid Formula: C14H16N2O5S2 MolecularWeight: 356.41724

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC2=C1N=C(N(C2=O)CCCCCC(=O)O)SCC(=O)O

Isomeric SMILES

C1=CSC2=C1N=C(N(C2=O)CCCCCC(=O)O)SCC(=O)O

InChI

InChI=1S/C14H16N2O5S2/c17-10(18)4-2-1-3-6-16-13(21)12-9(5-7-22-12)15-14(16)23-8-11(19)20/h5,7H,1-4,6,8H2,(H,17,18)(H,19,20)