2-(4-bromanylthiophen-2-yl)-4-ethyl-5,6-dihydrothieno[3,2-b]thiopyran-4-ium-7-one tetrafluoroborate

Systemtic Name: 2-(4-bromanylthiophen-2-yl)-4-ethyl-5,6-dihydrothieno[3,2-b]thiopyran-4-ium-7-one tetrafluoroborate Openeye Name: 2-(4-bromo-2-thienyl)-4-ethyl-5,6-dihydrothieno[3,2-b]thiopyran-4-ium-7-one tetrafluoroborate CAS Name: 2-(4-bromo-2-thiophenyl)-4-ethyl-5,6-dihydrothieno[3,2-b]thiopyran-4-ium-7-one tetrafluoroborate IUPAC Name: 2-(4-bromothiophen-2-yl)-4-ethyl-5,6-dihydrothieno[3,2-b]thiopyran-4-ium-7-one tetrafluoroborate Traditional Name: 2-(4-bromo-2-thienyl)-4-ethyl-5,6-dihydrothieno[3,2-b]thiopyran-4-ium-7-one tetrafluoroborate Formula: C13H12BBrF4OS3 MolecularWeight: 447.137393

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CC[S+]1CCC(=O)C2=C1C=C(S2)C3=CC(=CS3)Br

Isomeric SMILES

[B-](F)(F)(F)F.CC[S+]1CCC(=O)C2=C1C=C(S2)C3=CC(=CS3)Br

InChI

InChI=1S/C13H12BrOS3.BF4/c1-2-18-4-3-9(15)13-12(18)6-11(17-13)10-5-8(14)7-16-10;2-1(3,4)5/h5-7H,2-4H2,1H3;/q+1;-1