2-[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxidanylidene-ethyl]sulfanylquinazolin-4-olate

Systemtic Name: 2-[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxidanylidene-ethyl]sulfanylquinazolin-4-olate Openeye Name: 2-[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxo-ethyl]sulfanylquinazolin-4-olate CAS Name: 2-[[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxoethyl]thio]-4-quinazolinolate IUPAC Name: 2-[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxoethyl]sulfanylquinazolin-4-olate Traditional Name: 2-[[2-keto-2-(piazthiol-4-ylamino)ethyl]thio]quinazolin-4-olate Formula: C16H10N5O2S2- MolecularWeight: 368.4129

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)SCC(=O)NC3=CC=CC4=NSN=C43)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)SCC(=O)NC3=CC=CC4=NSN=C43)[O-]

InChI

InChI=1S/C16H11N5O2S2/c22-13(17-11-6-3-7-12-14(11)21-25-20-12)8-24-16-18-10-5-2-1-4-9(10)15(23)19-16/h1-7H,8H2,(H,17,22)(H,18,19,23)/p-1