N-(1,3-benzodioxol-5-ylmethyl)-2-(phenylsulfonylamino)-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(phenylsulfonylamino)-1,3-benzothiazole-6-carboxamide Openeye Name: 2-(benzenesulfonamido)-N-(1,3-benzodioxol-5-ylmethyl)-1,3-benzothiazole-6-carboxamide CAS Name: 2-(benzenesulfonamido)-N-(1,3-benzodioxol-5-ylmethyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-(benzenesulfonamido)-N-(1,3-benzodioxol-5-ylmethyl)-1,3-benzothiazole-6-carboxamide Traditional Name: 2-(benzenesulfonamido)-N-piperonyl-1,3-benzothiazole-6-carboxamide Formula: C22H17N3O5S2 MolecularWeight: 467.51748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC4=C(C=C3)N=C(S4)NS(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC4=C(C=C3)N=C(S4)NS(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C22H17N3O5S2/c26-21(23-12-14-6-9-18-19(10-14)30-13-29-18)15-7-8-17-20(11-15)31-22(24-17)25-32(27,28)16-4-2-1-3-5-16/h1-11H,12-13H2,(H,23,26)(H,24,25)