2-[2-(phenylmethyl)sulfonylethylsulfanyl]-1,3-benzothiazole

Systemtic Name: 2-[2-(phenylmethyl)sulfonylethylsulfanyl]-1,3-benzothiazole Openeye Name: 2-(2-benzylsulfonylethylsulfanyl)-1,3-benzothiazole CAS Name: 2-[2-(phenylmethyl)sulfonylethylthio]-1,3-benzothiazole IUPAC Name: 2-(2-benzylsulfonylethylsulfanyl)-1,3-benzothiazole Traditional Name: 2-(2-benzylsulfonylethylthio)-1,3-benzothiazole Formula: C16H15NO2S3 MolecularWeight: 349.4908

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)CCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)CCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H15NO2S3/c18-22(19,12-13-6-2-1-3-7-13)11-10-20-16-17-14-8-4-5-9-15(14)21-16/h1-9H,10-12H2