2-[(4-oxidanylidene-6-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]ethanoate

Systemtic Name: 2-[(4-oxidanylidene-6-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]ethanoate Openeye Name: 2-[(4-oxo-6-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate CAS Name: 2-[(4-oxo-6-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)thio]acetate IUPAC Name: 2-[(4-oxo-6-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate Traditional Name: 2-[(4-keto-6-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)thio]acetate Formula: C14H9N2O3S2- MolecularWeight: 317.36286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=C(S2)N=C(NC3=O)SCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=C(S2)N=C(NC3=O)SCC(=O)[O-]

InChI

InChI=1S/C14H10N2O3S2/c17-11(18)7-20-14-15-12(19)9-6-10(21-13(9)16-14)8-4-2-1-3-5-8/h1-6H,7H2,(H,17,18)(H,15,16,19)/p-1