S-[2-[(2E)-2-ethenoxycarbonylimino-6-(trifluoromethyloxy)-1,3-benzothiazol-3-yl]ethyl] ethanethioate

Systemtic Name: S-[2-[(2E)-2-ethenoxycarbonylimino-6-(trifluoromethyloxy)-1,3-benzothiazol-3-yl]ethyl] ethanethioate Openeye Name: S-[2-[(2E)-6-(trifluoromethoxy)-2-vinyloxycarbonylimino-1,3-benzothiazol-3-yl]ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[(2E)-2-[ethenoxy(oxo)methyl]imino-6-(trifluoromethoxy)-1,3-benzothiazol-3-yl]ethyl] ester IUPAC Name: S-[2-[(2E)-2-ethenoxycarbonylimino-6-(trifluoromethoxy)-1,3-benzothiazol-3-yl]ethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-[(2E)-6-(trifluoromethoxy)-2-vinyloxycarbonylimino-1,3-benzothiazol-3-yl]ethyl] ester Formula: C15H13F3N2O4S2 MolecularWeight: 406.39993

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCN1C2=C(C=C(C=C2)OC(F)(F)F)SC1=NC(=O)OC=C

Isomeric SMILES

CC(=O)SCCN\1C2=C(C=C(C=C2)OC(F)(F)F)S/C1=N/C(=O)OC=C

InChI

InChI=1S/C15H13F3N2O4S2/c1-3-23-14(22)19-13-20(6-7-25-9(2)21)11-5-4-10(8-12(11)26-13)24-15(16,17)18/h3-5,8H,1,6-7H2,2H3/b19-13+