S-[(3-methyl-2H-1,2,3-thiadiazol-2-ium-4-yl)methyl] ethanethioate; tris(fluoranyl)methanesulfonate

Systemtic Name: S-[(3-methyl-2H-1,2,3-thiadiazol-2-ium-4-yl)methyl] ethanethioate; tris(fluoranyl)methanesulfonate Openeye Name: S-[(3-methyl-2H-thiadiazol-2-ium-4-yl)methyl] ethanethioate; trifluoromethanesulfonate CAS Name: ethanethioic acid S-[(3-methyl-2H-thiadiazol-2-ium-4-yl)methyl] ester; trifluoromethanesulfonate IUPAC Name: S-[(3-methyl-2H-thiadiazol-2-ium-4-yl)methyl] ethanethioate; trifluoromethanesulfonate Traditional Name: ethanethioic acid S-[(3-methyl-2H-thiadiazol-2-ium-4-yl)methyl] ester triflate Formula: C7H11F3N2O4S3 MolecularWeight: 340.36345

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC1=CS[NH2+]N1C.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CC(=O)SCC1=CS[NH2+]N1C.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C6H10N2OS2.CHF3O3S/c1-5(9)10-3-6-4-11-7-8(6)2;2-1(3,4)8(5,6)7/h4,7H,3H2,1-2H3;(H,5,6,7)