2-[(6-piperidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)sulfanyl]-N-(2,4,6-trimethylphenyl)ethanamide

Systemtic Name: 2-[(6-piperidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)sulfanyl]-N-(2,4,6-trimethylphenyl)ethanamide Openeye Name: 2-[[6-(1-piperidylsulfonyl)-1,3-benzothiazol-2-yl]sulfanyl]-N-(2,4,6-trimethylphenyl)acetamide CAS Name: 2-[[6-(1-piperidinylsulfonyl)-1,3-benzothiazol-2-yl]thio]-N-(2,4,6-trimethylphenyl)acetamide IUPAC Name: 2-[(6-piperidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)sulfanyl]-N-(2,4,6-trimethylphenyl)acetamide Traditional Name: N-mesityl-2-[(6-piperidinosulfonyl-1,3-benzothiazol-2-yl)thio]acetamide Formula: C23H27N3O3S3 MolecularWeight: 489.67378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)N4CCCCC4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)CSC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)N4CCCCC4)C

InChI

InChI=1S/C23H27N3O3S3/c1-15-11-16(2)22(17(3)12-15)25-21(27)14-30-23-24-19-8-7-18(13-20(19)31-23)32(28,29)26-9-5-4-6-10-26/h7-8,11-13H,4-6,9-10,14H2,1-3H3,(H,25,27)