2-(4-chlorophenyl)sulfanyl-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)ethanamide

Systemtic Name: 2-(4-chlorophenyl)sulfanyl-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-(4-chlorophenyl)sulfanyl-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[(4-chlorophenyl)thio]-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-(4-chlorophenyl)sulfanyl-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: N-benzyl-2-[(4-chlorophenyl)thio]-N-(4-mesyl-1,3-benzothiazol-2-yl)acetamide Formula: C23H19ClN2O3S3 MolecularWeight: 503.05656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC2=C1N=C(S2)N(CC3=CC=CC=C3)C(=O)CSC4=CC=C(C=C4)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=CC2=C1N=C(S2)N(CC3=CC=CC=C3)C(=O)CSC4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H19ClN2O3S3/c1-32(28,29)20-9-5-8-19-22(20)25-23(31-19)26(14-16-6-3-2-4-7-16)21(27)15-30-18-12-10-17(24)11-13-18/h2-13H,14-15H2,1H3