N-[azanyl(thiomorpholin-4-ium-4-ylidene)methyl]-3,5-bis(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-[azanyl(thiomorpholin-4-ium-4-ylidene)methyl]-3,5-bis(trifluoromethyl)benzenesulfonamide Openeye Name: N-[amino(thiomorpholin-4-ium-4-ylidene)methyl]-3,5-bis(trifluoromethyl)benzenesulfonamide CAS Name: N-[amino(4-thiomorpholin-4-iumylidene)methyl]-3,5-bis(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[amino(thiomorpholin-4-ium-4-ylidene)methyl]-3,5-bis(trifluoromethyl)benzenesulfonamide Traditional Name: N-[amino(thiomorpholin-4-ium-4-ylidene)methyl]-3,5-bis(trifluoromethyl)benzenesulfonamide Formula: C13H14F6N3O2S2+ MolecularWeight: 422.389579

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCC[N+]1=C(N)NS(=O)(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1CSCC[N+]1=C(N)NS(=O)(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C13H13F6N3O2S2/c14-12(15,16)8-5-9(13(17,18)19)7-10(6-8)26(23,24)21-11(20)22-1-3-25-4-2-22/h5-7H,1-4H2,(H2,20,21)/p+1