N-(1,3-benzothiazol-2-yl)-4-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)benzenesulfonamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-4-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)benzenesulfonamide Openeye Name: N-(1,3-benzothiazol-2-yl)-4-(4-oxo-2-thioxo-1H-quinazolin-3-yl)benzenesulfonamide CAS Name: N-(1,3-benzothiazol-2-yl)-4-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)benzenesulfonamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-4-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)benzenesulfonamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-(4-keto-2-thioxo-1H-quinazolin-3-yl)benzenesulfonamide Formula: C21H14N4O3S3 MolecularWeight: 466.55586

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)C3=CC=C(C=C3)S(=O)(=O)NC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)C3=CC=C(C=C3)S(=O)(=O)NC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C21H14N4O3S3/c26-19-15-5-1-2-6-16(15)23-21(29)25(19)13-9-11-14(12-10-13)31(27,28)24-20-22-17-7-3-4-8-18(17)30-20/h1-12H,(H,22,24)(H,23,29)