2-[[8-chloranyl-4,4-dimethyl-1,1-bis(oxidanylidene)-2,3-dihydrothiochromen-7-yl]carbonyl]-3-ethylsulfanyl-cyclohex-2-en-1-one

Systemtic Name: 2-[[8-chloranyl-4,4-dimethyl-1,1-bis(oxidanylidene)-2,3-dihydrothiochromen-7-yl]carbonyl]-3-ethylsulfanyl-cyclohex-2-en-1-one Openeye Name: 2-(8-chloro-4,4-dimethyl-1,1-dioxo-2,3-dihydrothiochromene-7-carbonyl)-3-ethylsulfanyl-cyclohex-2-en-1-one CAS Name: 2-[(8-chloro-4,4-dimethyl-1,1-dioxo-2,3-dihydro-1-benzothiopyran-7-yl)-oxomethyl]-3-(ethylthio)-1-cyclohex-2-enone IUPAC Name: 2-(8-chloro-4,4-dimethyl-1,1-dioxo-2,3-dihydrothiochromene-7-carbonyl)-3-ethylsulfanylcyclohex-2-en-1-one Traditional Name: 2-(8-chloro-1,1-diketo-4,4-dimethyl-2,3-dihydrothiochromene-7-carbonyl)-3-(ethylthio)cyclohex-2-en-1-one Formula: C20H23ClO4S2 MolecularWeight: 426.97722

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C(=O)CCC1)C(=O)C2=C(C3=C(C=C2)C(CCS3(=O)=O)(C)C)Cl

Isomeric SMILES

CCSC1=C(C(=O)CCC1)C(=O)C2=C(C3=C(C=C2)C(CCS3(=O)=O)(C)C)Cl

InChI

InChI=1S/C20H23ClO4S2/c1-4-26-15-7-5-6-14(22)16(15)18(23)12-8-9-13-19(17(12)21)27(24,25)11-10-20(13,2)3/h8-9H,4-7,10-11H2,1-3H3