2-(4-chlorophenyl)sulfonyl-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)ethanamide

Systemtic Name: 2-(4-chlorophenyl)sulfonyl-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)ethanamide Openeye Name: 2-(4-chlorophenyl)sulfonyl-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)acetamide CAS Name: 2-(4-chlorophenyl)sulfonyl-N-[2-(methylthio)-1,3-benzothiazol-6-yl]acetamide IUPAC Name: 2-(4-chlorophenyl)sulfonyl-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)acetamide Traditional Name: 2-(4-chlorophenyl)sulfonyl-N-[2-(methylthio)-1,3-benzothiazol-6-yl]acetamide Formula: C16H13ClN2O3S3 MolecularWeight: 412.93402

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)CS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)CS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H13ClN2O3S3/c1-23-16-19-13-7-4-11(8-14(13)24-16)18-15(20)9-25(21,22)12-5-2-10(17)3-6-12/h2-8H,9H2,1H3,(H,18,20)