3-(2,5,6-trimethylthieno[2,3-d][1,3]thiazol-3-ium-3-yl)propane-1-sulfonate

Systemtic Name: 3-(2,5,6-trimethylthieno[2,3-d][1,3]thiazol-3-ium-3-yl)propane-1-sulfonate Openeye Name: 3-(2,5,6-trimethylthieno[2,3-d]thiazol-3-ium-3-yl)propane-1-sulfonate CAS Name: 3-(2,5,6-trimethyl-3-thieno[2,3-d]thiazol-3-iumyl)-1-propanesulfonate IUPAC Name: 3-(2,5,6-trimethylthieno[2,3-d][1,3]thiazol-3-ium-3-yl)propane-1-sulfonate Traditional Name: 3-(2,5,6-trimethylthieno[2,3-d]thiazol-3-ium-3-yl)propane-1-sulfonate Formula: C11H15NO3S3 MolecularWeight: 305.4367

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1SC(=[N+]2CCCS(=O)(=O)[O-])C)C

Isomeric SMILES

CC1=C(SC2=C1SC(=[N+]2CCCS(=O)(=O)[O-])C)C

InChI

InChI=1S/C11H15NO3S3/c1-7-8(2)16-11-10(7)17-9(3)12(11)5-4-6-18(13,14)15/h4-6H2,1-3H3