2-thieno[2,3-d]pyrimidin-4-ylsulfanylbenzoate

Systemtic Name: 2-thieno[2,3-d]pyrimidin-4-ylsulfanylbenzoate Openeye Name: 2-thieno[2,3-d]pyrimidin-4-ylsulfanylbenzoate CAS Name: 2-(4-thieno[2,3-d]pyrimidinylthio)benzoate IUPAC Name: 2-thieno[2,3-d]pyrimidin-4-ylsulfanylbenzoate Traditional Name: 2-(thieno[2,3-d]pyrimidin-4-ylthio)benzoate Formula: C13H7N2O2S2- MolecularWeight: 287.33688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)[O-])SC2=NC=NC3=C2C=CS3

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)[O-])SC2=NC=NC3=C2C=CS3

InChI

InChI=1S/C13H8N2O2S2/c16-13(17)8-3-1-2-4-10(8)19-12-9-5-6-18-11(9)14-7-15-12/h1-7H,(H,16,17)/p-1