N-[3-(2-methylsulfanylethyl)-6-methylsulfonyl-1,3-benzothiazol-2-ylidene]-2-(phenylsulfonyl)ethanamide

Systemtic Name: N-[3-(2-methylsulfanylethyl)-6-methylsulfonyl-1,3-benzothiazol-2-ylidene]-2-(phenylsulfonyl)ethanamide Openeye Name: 2-(benzenesulfonyl)-N-[3-(2-methylsulfanylethyl)-6-methylsulfonyl-1,3-benzothiazol-2-ylidene]acetamide CAS Name: 2-(benzenesulfonyl)-N-[6-methylsulfonyl-3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]acetamide IUPAC Name: 2-(benzenesulfonyl)-N-[3-(2-methylsulfanylethyl)-6-methylsulfonyl-1,3-benzothiazol-2-ylidene]acetamide Traditional Name: 2-besyl-N-[6-mesyl-3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]acetamide Formula: C19H20N2O5S4 MolecularWeight: 484.6325

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Descriptors Computed from Structure

Canonical SMILES:

CSCCN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)CS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CSCCN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)CS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H20N2O5S4/c1-27-11-10-21-16-9-8-15(29(2,23)24)12-17(16)28-19(21)20-18(22)13-30(25,26)14-6-4-3-5-7-14/h3-9,12H,10-11,13H2,1-2H3