5-(4-oxidanylidene-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)pentanoic acid

Systemtic Name: 5-(4-oxidanylidene-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)pentanoic acid Openeye Name: 5-(4-oxo-2-thioxo-1H-thieno[3,2-d]pyrimidin-3-yl)pentanoic acid CAS Name: 5-(4-oxo-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)pentanoic acid IUPAC Name: 5-(4-oxo-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)pentanoic acid Traditional Name: 5-(4-keto-2-thioxo-1H-thieno[3,2-d]pyrimidin-3-yl)valeric acid Formula: C11H12N2O3S2 MolecularWeight: 284.35458

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC2=C1NC(=S)N(C2=O)CCCCC(=O)O

Isomeric SMILES

C1=CSC2=C1NC(=S)N(C2=O)CCCCC(=O)O

InChI

InChI=1S/C11H12N2O3S2/c14-8(15)3-1-2-5-13-10(16)9-7(4-6-18-9)12-11(13)17/h4,6H,1-3,5H2,(H,12,17)(H,14,15)