3-(5-oxidanylidene-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)propanoate

Systemtic Name: 3-(5-oxidanylidene-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)propanoate Openeye Name: 3-(5-oxo-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)propanoate CAS Name: 3-(5-oxo-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)propanoate IUPAC Name: 3-(5-oxo-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)propanoate Traditional Name: 3-(5-keto-[1,3,4]thiadiazolo[2,3-b]quinazolin-2-yl)propionate Formula: C12H8N3O3S- MolecularWeight: 274.27522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N3C(=N2)SC(=N3)CCC(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N3C(=N2)SC(=N3)CCC(=O)[O-]

InChI

InChI=1S/C12H9N3O3S/c16-10(17)6-5-9-14-15-11(18)7-3-1-2-4-8(7)13-12(15)19-9/h1-4H,5-6H2,(H,16,17)/p-1