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

Systemtic Name: N-[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]-2-(4-methylsulfonylphenyl)ethanamide Openeye Name: N-[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]-2-(4-methylsulfonylphenyl)acetamide CAS Name: N-[2-(2-methoxyethoxymethylthio)-1,3-benzothiazol-6-yl]-2-(4-methylsulfonylphenyl)acetamide IUPAC Name: N-[2-(2-methoxyethoxymethylsulfanyl)-1,3-benzothiazol-6-yl]-2-(4-methylsulfonylphenyl)acetamide Traditional Name: 2-(4-mesylphenyl)-N-[2-(2-methoxyethoxymethylthio)-1,3-benzothiazol-6-yl]acetamide Formula: C20H22N2O5S3 MolecularWeight: 466.59408

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Descriptors Computed from Structure

Canonical SMILES:

COCCOCSC1=NC2=C(S1)C=C(C=C2)NC(=O)CC3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

COCCOCSC1=NC2=C(S1)C=C(C=C2)NC(=O)CC3=CC=C(C=C3)S(=O)(=O)C

InChI

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