4-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoyl]-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 4-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoyl]-N,N-dimethyl-benzenesulfonamide Openeye Name: 4-[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]-N,N-dimethyl-benzenesulfonamide CAS Name: 4-[2-(1,3-benzothiazol-2-ylthio)-1-oxoethyl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 4-[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]-N,N-dimethylbenzenesulfonamide Traditional Name: 4-[2-(1,3-benzothiazol-2-ylthio)acetyl]-N,N-dimethyl-benzenesulfonamide Formula: C17H16N2O3S3 MolecularWeight: 392.51554

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H16N2O3S3/c1-19(2)25(21,22)13-9-7-12(8-10-13)15(20)11-23-17-18-14-5-3-4-6-16(14)24-17/h3-10H,11H2,1-2H3