N-(6-cyano-1,3-benzodioxol-5-yl)-2-oxidanylidene-3H-1,3-benzothiazole-6-sulfonamide

Systemtic Name: N-(6-cyano-1,3-benzodioxol-5-yl)-2-oxidanylidene-3H-1,3-benzothiazole-6-sulfonamide Openeye Name: N-(6-cyano-1,3-benzodioxol-5-yl)-2-oxo-3H-1,3-benzothiazole-6-sulfonamide CAS Name: N-(6-cyano-1,3-benzodioxol-5-yl)-2-oxo-3H-1,3-benzothiazole-6-sulfonamide IUPAC Name: N-(6-cyano-1,3-benzodioxol-5-yl)-2-oxo-3H-1,3-benzothiazole-6-sulfonamide Traditional Name: N-(6-cyano-1,3-benzodioxol-5-yl)-2-keto-3H-1,3-benzothiazole-6-sulfonamide Formula: C15H9N3O5S2 MolecularWeight: 375.37906

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C#N)NS(=O)(=O)C3=CC4=C(C=C3)NC(=O)S4

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)C#N)NS(=O)(=O)C3=CC4=C(C=C3)NC(=O)S4

InChI

InChI=1S/C15H9N3O5S2/c16-6-8-3-12-13(23-7-22-12)5-11(8)18-25(20,21)9-1-2-10-14(4-9)24-15(19)17-10/h1-5,18H,7H2,(H,17,19)