N-benzo[e][1,3]benzothiazol-2-yl-4-cyano-benzenesulfonamide

Systemtic Name: N-benzo[e][1,3]benzothiazol-2-yl-4-cyano-benzenesulfonamide Openeye Name: N-benzo[e][1,3]benzothiazol-2-yl-4-cyano-benzenesulfonamide CAS Name: N-(2-benzo[e][1,3]benzothiazolyl)-4-cyanobenzenesulfonamide IUPAC Name: N-benzo[e][1,3]benzothiazol-2-yl-4-cyanobenzenesulfonamide Traditional Name: N-benzo[e][1,3]benzothiazol-2-yl-4-cyano-benzenesulfonamide Formula: C18H11N3O2S2 MolecularWeight: 365.42884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2N=C(S3)NS(=O)(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2N=C(S3)NS(=O)(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C18H11N3O2S2/c19-11-12-5-8-14(9-6-12)25(22,23)21-18-20-17-15-4-2-1-3-13(15)7-10-16(17)24-18/h1-10H,(H,20,21)