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

Systemtic Name: 2-[[4-chloranyl-1,1-bis(oxidanylidene)-2,3-dihydro-1-benzothiophen-5-yl]carbonyl]-3-propan-2-ylsulfanyl-cyclohexan-1-one Openeye Name: 2-(4-chloro-1,1-dioxo-2,3-dihydrobenzothiophene-5-carbonyl)-3-isopropylsulfanyl-cyclohexanone CAS Name: 2-[(4-chloro-1,1-dioxo-2,3-dihydro-1-benzothiophen-5-yl)-oxomethyl]-3-(propan-2-ylthio)-1-cyclohexanone IUPAC Name: 2-(4-chloro-1,1-dioxo-2,3-dihydro-1-benzothiophene-5-carbonyl)-3-propan-2-ylsulfanylcyclohexan-1-one Traditional Name: 2-(4-chloro-1,1-diketo-2,3-dihydrobenzothiophene-5-carbonyl)-3-(isopropylthio)cyclohexanone Formula: C18H21ClO4S2 MolecularWeight: 400.93994

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21ClO4S2/c1-10(2)24-14-5-3-4-13(20)16(14)18(21)12-6-7-15-11(17(12)19)8-9-25(15,22)23/h6-7,10,14,16H,3-5,8-9H2,1-2H3