1-[3,4-bis(chloranyl)-1,2-thiazol-5-yl]-2-(phenylmethylsulfanyl)ethanone

Systemtic Name: 1-[3,4-bis(chloranyl)-1,2-thiazol-5-yl]-2-(phenylmethylsulfanyl)ethanone Openeye Name: 2-benzylsulfanyl-1-(3,4-dichloroisothiazol-5-yl)ethanone CAS Name: 1-(3,4-dichloro-5-isothiazolyl)-2-(phenylmethylthio)ethanone IUPAC Name: 2-benzylsulfanyl-1-(3,4-dichloro-1,2-thiazol-5-yl)ethanone Traditional Name: 2-(benzylthio)-1-(3,4-dichloroisothiazol-5-yl)ethanone Formula: C12H9Cl2NOS2 MolecularWeight: 318.24196

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC(=O)C2=C(C(=NS2)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)CSCC(=O)C2=C(C(=NS2)Cl)Cl

InChI

InChI=1S/C12H9Cl2NOS2/c13-10-11(18-15-12(10)14)9(16)7-17-6-8-4-2-1-3-5-8/h1-5H,6-7H2