N-[6-(dipropylsulfamoyl)-1,3-benzothiazol-2-yl]-2-(phenylmethylsulfanyl)ethanamide

Systemtic Name: N-[6-(dipropylsulfamoyl)-1,3-benzothiazol-2-yl]-2-(phenylmethylsulfanyl)ethanamide Openeye Name: 2-benzylsulfanyl-N-[6-(dipropylsulfamoyl)-1,3-benzothiazol-2-yl]acetamide CAS Name: N-[6-(dipropylsulfamoyl)-1,3-benzothiazol-2-yl]-2-(phenylmethylthio)acetamide IUPAC Name: 2-benzylsulfanyl-N-[6-(dipropylsulfamoyl)-1,3-benzothiazol-2-yl]acetamide Traditional Name: 2-(benzylthio)-N-[6-(dipropylsulfamoyl)-1,3-benzothiazol-2-yl]acetamide Formula: C22H27N3O3S3 MolecularWeight: 477.66308

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)S(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CSCC3=CC=CC=C3

Isomeric SMILES

CCCN(CCC)S(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CSCC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O3S3/c1-3-12-25(13-4-2)31(27,28)18-10-11-19-20(14-18)30-22(23-19)24-21(26)16-29-15-17-8-6-5-7-9-17/h5-11,14H,3-4,12-13,15-16H2,1-2H3,(H,23,24,26)