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

Systemtic Name: 2-(4-bromanylthiophen-2-yl)-4-ethyl-5,6-dihydrothieno[3,2-b]thiopyran-4-ium-7-one Openeye Name: 2-(4-bromo-2-thienyl)-4-ethyl-5,6-dihydrothieno[3,2-b]thiopyran-4-ium-7-one CAS Name: 2-(4-bromo-2-thiophenyl)-4-ethyl-5,6-dihydrothieno[3,2-b]thiopyran-4-ium-7-one IUPAC Name: 2-(4-bromothiophen-2-yl)-4-ethyl-5,6-dihydrothieno[3,2-b]thiopyran-4-ium-7-one Traditional Name: 2-(4-bromo-2-thienyl)-4-ethyl-5,6-dihydrothieno[3,2-b]thiopyran-4-ium-7-one Formula: C13H12BrOS3+ MolecularWeight: 360.33278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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