N-dodecyl-N-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)sulfanyl]ethanamide

Systemtic Name: N-dodecyl-N-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)sulfanyl]ethanamide Openeye Name: N-dodecyl-N-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)sulfanyl]acetamide CAS Name: N-dodecyl-N-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)thio]acetamide IUPAC Name: N-dodecyl-N-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)sulfanyl]acetamide Traditional Name: N-lauryl-N-[(6-mesyl-1,3-benzothiazol-2-yl)thio]acetamide Formula: C22H34N2O3S3 MolecularWeight: 470.71196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN(C(=O)C)SC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CCCCCCCCCCCCN(C(=O)C)SC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C22H34N2O3S3/c1-4-5-6-7-8-9-10-11-12-13-16-24(18(2)25)29-22-23-20-15-14-19(30(3,26)27)17-21(20)28-22/h14-15,17H,4-13,16H2,1-3H3