7-oxidanylidene-2-phenacylsulfanyl-4H-[1,3]thiazolo[4,5-d]pyrimidin-5-olate

Systemtic Name: 7-oxidanylidene-2-phenacylsulfanyl-4H-[1,3]thiazolo[4,5-d]pyrimidin-5-olate Openeye Name: 7-oxo-2-phenacylsulfanyl-4H-thiazolo[4,5-d]pyrimidin-5-olate CAS Name: 7-oxo-2-(phenacylthio)-4H-thiazolo[4,5-d]pyrimidin-5-olate IUPAC Name: 7-oxo-2-phenacylsulfanyl-4H-[1,3]thiazolo[4,5-d]pyrimidin-5-olate Traditional Name: 7-keto-2-(phenacylthio)-4H-thiazolo[4,5-d]pyrimidin-5-olate Formula: C13H8N3O3S2- MolecularWeight: 318.35092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CSC2=NC3=C(S2)C(=O)N=C(N3)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CSC2=NC3=C(S2)C(=O)N=C(N3)[O-]

InChI

InChI=1S/C13H9N3O3S2/c17-8(7-4-2-1-3-5-7)6-20-13-15-10-9(21-13)11(18)16-12(19)14-10/h1-5H,6H2,(H2,14,16,18,19)/p-1