N-(2-methyl-1,3-benzothiazol-5-yl)-4-pentyl-benzenesulfonamide

Systemtic Name: N-(2-methyl-1,3-benzothiazol-5-yl)-4-pentyl-benzenesulfonamide Openeye Name: N-(2-methyl-1,3-benzothiazol-5-yl)-4-pentyl-benzenesulfonamide CAS Name: N-(2-methyl-1,3-benzothiazol-5-yl)-4-pentylbenzenesulfonamide IUPAC Name: N-(2-methyl-1,3-benzothiazol-5-yl)-4-pentylbenzenesulfonamide Traditional Name: 4-amyl-N-(2-methyl-1,3-benzothiazol-5-yl)benzenesulfonamide Formula: C19H22N2O2S2 MolecularWeight: 374.52018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)SC(=N3)C

Isomeric SMILES

CCCCCC1=CC=C(C=C1)S(=O)(=O)NC2=CC3=C(C=C2)SC(=N3)C

InChI

InChI=1S/C19H22N2O2S2/c1-3-4-5-6-15-7-10-17(11-8-15)25(22,23)21-16-9-12-19-18(13-16)20-14(2)24-19/h7-13,21H,3-6H2,1-2H3