2-[[5-chloranyl-1,1-bis(oxidanylidene)-3,4-dihydro-2H-thiochromen-6-yl]carbonyl]-3-methylsulfanyl-cyclohex-2-en-1-one

Systemtic Name: 2-[[5-chloranyl-1,1-bis(oxidanylidene)-3,4-dihydro-2H-thiochromen-6-yl]carbonyl]-3-methylsulfanyl-cyclohex-2-en-1-one Openeye Name: 2-(5-chloro-1,1-dioxo-3,4-dihydro-2H-thiochromene-6-carbonyl)-3-methylsulfanyl-cyclohex-2-en-1-one CAS Name: 2-[(5-chloro-1,1-dioxo-3,4-dihydro-2H-1-benzothiopyran-6-yl)-oxomethyl]-3-(methylthio)-1-cyclohex-2-enone IUPAC Name: 2-(5-chloro-1,1-dioxo-3,4-dihydro-2H-thiochromene-6-carbonyl)-3-methylsulfanylcyclohex-2-en-1-one Traditional Name: 2-(5-chloro-1,1-diketo-3,4-dihydro-2H-thiochromene-6-carbonyl)-3-(methylthio)cyclohex-2-en-1-one Formula: C17H17ClO4S2 MolecularWeight: 384.89748

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=O)CCC1)C(=O)C2=C(C3=C(C=C2)S(=O)(=O)CCC3)Cl

Isomeric SMILES

CSC1=C(C(=O)CCC1)C(=O)C2=C(C3=C(C=C2)S(=O)(=O)CCC3)Cl

InChI

InChI=1S/C17H17ClO4S2/c1-23-13-6-2-5-12(19)15(13)17(20)11-7-8-14-10(16(11)18)4-3-9-24(14,21)22/h7-8H,2-6,9H2,1H3