N-[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]-2-(4-methylphenyl)sulfonyl-ethanamide

Systemtic Name: N-[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]-2-(4-methylphenyl)sulfonyl-ethanamide Openeye Name: N-[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]-2-(p-tolylsulfonyl)acetamide CAS Name: N-[2-(2-methoxyethoxymethylthio)-1,3-benzothiazol-6-yl]-2-(4-methylphenyl)sulfonylacetamide IUPAC Name: N-[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]-2-(4-methylphenyl)sulfonylacetamide Traditional Name: N-[2-(2-methoxyethoxymethylthio)-1,3-benzothiazol-6-yl]-2-tosyl-acetamide Formula: C20H22N2O5S3 MolecularWeight: 466.59408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)NC2=CC3=C(C=C2)N=C(S3)SCOCCOC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)NC2=CC3=C(C=C2)N=C(S3)SCOCCOC

InChI

InChI=1S/C20H22N2O5S3/c1-14-3-6-16(7-4-14)30(24,25)12-19(23)21-15-5-8-17-18(11-15)29-20(22-17)28-13-27-10-9-26-2/h3-8,11H,9-10,12-13H2,1-2H3,(H,21,23)