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

Systemtic Name: 2-[[4-chloranyl-1,1-bis(oxidanylidene)-2,3-dihydro-1-benzothiophen-5-yl]carbonyl]-3-prop-2-enylsulfanyl-cyclohexan-1-one Openeye Name: 3-allylsulfanyl-2-(4-chloro-1,1-dioxo-2,3-dihydrobenzothiophene-5-carbonyl)cyclohexanone CAS Name: 2-[(4-chloro-1,1-dioxo-2,3-dihydro-1-benzothiophen-5-yl)-oxomethyl]-3-(prop-2-enylthio)-1-cyclohexanone IUPAC Name: 2-(4-chloro-1,1-dioxo-2,3-dihydro-1-benzothiophene-5-carbonyl)-3-prop-2-enylsulfanylcyclohexan-1-one Traditional Name: 3-(allylthio)-2-(4-chloro-1,1-diketo-2,3-dihydrobenzothiophene-5-carbonyl)cyclohexanone Formula: C18H19ClO4S2 MolecularWeight: 398.92406

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1CCCC(=O)C1C(=O)C2=C(C3=C(C=C2)S(=O)(=O)CC3)Cl

Isomeric SMILES

C=CCSC1CCCC(=O)C1C(=O)C2=C(C3=C(C=C2)S(=O)(=O)CC3)Cl

InChI

InChI=1S/C18H19ClO4S2/c1-2-9-24-14-5-3-4-13(20)16(14)18(21)12-6-7-15-11(17(12)19)8-10-25(15,22)23/h2,6-7,14,16H,1,3-5,8-10H2