3-tert-butylsulfanyl-2-[[4-chloranyl-1,1-bis(oxidanylidene)-2,3-dihydro-1-benzothiophen-5-yl]carbonyl]cyclohexan-1-one

Systemtic Name: 3-tert-butylsulfanyl-2-[[4-chloranyl-1,1-bis(oxidanylidene)-2,3-dihydro-1-benzothiophen-5-yl]carbonyl]cyclohexan-1-one Openeye Name: 3-tert-butylsulfanyl-2-(4-chloro-1,1-dioxo-2,3-dihydrobenzothiophene-5-carbonyl)cyclohexanone CAS Name: 3-(tert-butylthio)-2-[(4-chloro-1,1-dioxo-2,3-dihydro-1-benzothiophen-5-yl)-oxomethyl]-1-cyclohexanone IUPAC Name: 3-tert-butylsulfanyl-2-(4-chloro-1,1-dioxo-2,3-dihydro-1-benzothiophene-5-carbonyl)cyclohexan-1-one Traditional Name: 3-(tert-butylthio)-2-(4-chloro-1,1-diketo-2,3-dihydrobenzothiophene-5-carbonyl)cyclohexanone Formula: C19H23ClO4S2 MolecularWeight: 414.96652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SC1CCCC(=O)C1C(=O)C2=C(C3=C(C=C2)S(=O)(=O)CC3)Cl

Isomeric SMILES

CC(C)(C)SC1CCCC(=O)C1C(=O)C2=C(C3=C(C=C2)S(=O)(=O)CC3)Cl

InChI

InChI=1S/C19H23ClO4S2/c1-19(2,3)25-14-6-4-5-13(21)16(14)18(22)12-7-8-15-11(17(12)20)9-10-26(15,23)24/h7-8,14,16H,4-6,9-10H2,1-3H3