methyl 2-[[5-chloranyl-1,1-bis(oxidanylidene)-1-benzothiophen-3-yl]methylsulfanyl]ethanoate

Systemtic Name: methyl 2-[[5-chloranyl-1,1-bis(oxidanylidene)-1-benzothiophen-3-yl]methylsulfanyl]ethanoate Openeye Name: methyl 2-[(5-chloro-1,1-dioxo-benzothiophen-3-yl)methylsulfanyl]acetate CAS Name: 2-[(5-chloro-1,1-dioxo-1-benzothiophen-3-yl)methylthio]acetic acid methyl ester IUPAC Name: methyl 2-[(5-chloro-1,1-dioxo-1-benzothiophen-3-yl)methylsulfanyl]acetate Traditional Name: 2-[(5-chloro-1,1-diketo-benzothiophen-3-yl)methylthio]acetic acid methyl ester Formula: C12H11ClO4S2 MolecularWeight: 318.79634

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSCC1=CS(=O)(=O)C2=C1C=C(C=C2)Cl

Isomeric SMILES

COC(=O)CSCC1=CS(=O)(=O)C2=C1C=C(C=C2)Cl

InChI

InChI=1S/C12H11ClO4S2/c1-17-12(14)6-18-5-8-7-19(15,16)11-3-2-9(13)4-10(8)11/h2-4,7H,5-6H2,1H3