3-[2-(4-methylphenyl)sulfonylethylsulfanylmethyl]-1-benzothiophene

Systemtic Name: 3-[2-(4-methylphenyl)sulfonylethylsulfanylmethyl]-1-benzothiophene Openeye Name: 3-[2-(p-tolylsulfonyl)ethylsulfanylmethyl]benzothiophene CAS Name: 3-[[2-(4-methylphenyl)sulfonylethylthio]methyl]-1-benzothiophene IUPAC Name: 3-[2-(4-methylphenyl)sulfonylethylsulfanylmethyl]-1-benzothiophene Traditional Name: 3-[(2-tosylethylthio)methyl]benzothiophene Formula: C18H18O2S3 MolecularWeight: 362.52932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCSCC2=CSC3=CC=CC=C32

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCSCC2=CSC3=CC=CC=C32

InChI

InChI=1S/C18H18O2S3/c1-14-6-8-16(9-7-14)23(19,20)11-10-21-12-15-13-22-18-5-3-2-4-17(15)18/h2-9,13H,10-12H2,1H3