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

Systemtic Name: 3-tert-butylsulfanyl-2-[4-chloranyl-1,1-bis(oxidanylidene)-2-(oxidanylidenemethylidene)-3H-1-benzothiophen-5-yl]cyclohexan-1-one Openeye Name: 3-tert-butylsulfanyl-2-[4-chloro-1,1-dioxo-2-(oxomethylene)-3H-benzothiophen-5-yl]cyclohexanone CAS Name: 3-(tert-butylthio)-2-[4-chloro-1,1-dioxo-2-(oxomethylidene)-3H-1-benzothiophen-5-yl]-1-cyclohexanone IUPAC Name: 3-tert-butylsulfanyl-2-[4-chloro-1,1-dioxo-2-(oxomethylidene)-3H-1-benzothiophen-5-yl]cyclohexan-1-one Traditional Name: 3-(tert-butylthio)-2-[4-chloro-1,1-diketo-2-(ketomethylene)-3H-benzothiophen-5-yl]cyclohexanone Formula: C19H21ClO4S2 MolecularWeight: 412.95064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SC1CCCC(=O)C1C2=C(C3=C(C=C2)S(=O)(=O)C(=C=O)C3)Cl

Isomeric SMILES

CC(C)(C)SC1CCCC(=O)C1C2=C(C3=C(C=C2)S(=O)(=O)C(=C=O)C3)Cl

InChI

InChI=1S/C19H21ClO4S2/c1-19(2,3)25-15-6-4-5-14(22)17(15)12-7-8-16-13(18(12)20)9-11(10-21)26(16,23)24/h7-8,15,17H,4-6,9H2,1-3H3