2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylbutanoate

Systemtic Name: 2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylbutanoate Openeye Name: 2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylbutanoate CAS Name: 2-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)thio]butanoate IUPAC Name: 2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylbutanoate Traditional Name: 2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]butyrate Formula: C12H13N2O2S2- MolecularWeight: 281.37382

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)[O-])SC1=NC=NC2=C1C(=C(S2)C)C

Isomeric SMILES

CCC(C(=O)[O-])SC1=NC=NC2=C1C(=C(S2)C)C

InChI

InChI=1S/C12H14N2O2S2/c1-4-8(12(15)16)18-11-9-6(2)7(3)17-10(9)13-5-14-11/h5,8H,4H2,1-3H3,(H,15,16)/p-1