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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[S+]1CCC(=O)C2=C1C=C(S2)C3=CC=C(S3)Br

Isomeric SMILES

CC[S+]1CCC(=O)C2=C1C=C(S2)C3=CC=C(S3)Br

InChI

InChI=1S/C13H12BrOS3/c1-2-18-6-5-8(15)13-11(18)7-10(17-13)9-3-4-12(14)16-9/h3-4,7H,2,5-6H2,1H3/q+1