N-(1,3-benzothiazol-2-ylmethyl)-3-cyano-benzenesulfonamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-3-cyano-benzenesulfonamide Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-3-cyano-benzenesulfonamide CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-3-cyanobenzenesulfonamide IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-3-cyanobenzenesulfonamide Traditional Name: N-(1,3-benzothiazol-2-ylmethyl)-3-cyano-benzenesulfonamide Formula: C15H11N3O2S2 MolecularWeight: 329.39674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CNS(=O)(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CNS(=O)(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C15H11N3O2S2/c16-9-11-4-3-5-12(8-11)22(19,20)17-10-15-18-13-6-1-2-7-14(13)21-15/h1-8,17H,10H2