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

Systemtic Name: 2-[(6-piperidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)sulfanyl]-N-[(2,4,6-trimethylphenyl)methyl]ethanamide Openeye Name: 2-[[6-(1-piperidylsulfonyl)-1,3-benzothiazol-2-yl]sulfanyl]-N-[(2,4,6-trimethylphenyl)methyl]acetamide CAS Name: 2-[[6-(1-piperidinylsulfonyl)-1,3-benzothiazol-2-yl]thio]-N-[(2,4,6-trimethylphenyl)methyl]acetamide IUPAC Name: 2-[(6-piperidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)sulfanyl]-N-[(2,4,6-trimethylphenyl)methyl]acetamide Traditional Name: 2-[(6-piperidinosulfonyl-1,3-benzothiazol-2-yl)thio]-N-(2,4,6-trimethylbenzyl)acetamide Formula: C24H29N3O3S3 MolecularWeight: 503.70036

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H29N3O3S3/c1-16-11-17(2)20(18(3)12-16)14-25-23(28)15-31-24-26-21-8-7-19(13-22(21)32-24)33(29,30)27-9-5-4-6-10-27/h7-8,11-13H,4-6,9-10,14-15H2,1-3H3,(H,25,28)