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

Systemtic Name: 3-butylsulfanyl-2-[[4-chloranyl-1,1-bis(oxidanylidene)-2,3-dihydro-1-benzothiophen-5-yl]carbonyl]cyclohex-2-en-1-one Openeye Name: 3-butylsulfanyl-2-(4-chloro-1,1-dioxo-2,3-dihydrobenzothiophene-5-carbonyl)cyclohex-2-en-1-one CAS Name: 3-(butylthio)-2-[(4-chloro-1,1-dioxo-2,3-dihydro-1-benzothiophen-5-yl)-oxomethyl]-1-cyclohex-2-enone IUPAC Name: 3-butylsulfanyl-2-(4-chloro-1,1-dioxo-2,3-dihydro-1-benzothiophene-5-carbonyl)cyclohex-2-en-1-one Traditional Name: 3-(butylthio)-2-(4-chloro-1,1-diketo-2,3-dihydrobenzothiophene-5-carbonyl)cyclohex-2-en-1-one Formula: C19H21ClO4S2 MolecularWeight: 412.95064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=C(C(=O)CCC1)C(=O)C2=C(C3=C(C=C2)S(=O)(=O)CC3)Cl

Isomeric SMILES

CCCCSC1=C(C(=O)CCC1)C(=O)C2=C(C3=C(C=C2)S(=O)(=O)CC3)Cl

InChI

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