dimethyl-[2-[(5-oxidanidyl-4-phenyl-1,2,5-oxadiazol-5-ium-3-yl)sulfanyl]ethyl]azanium

Systemtic Name: dimethyl-[2-[(5-oxidanidyl-4-phenyl-1,2,5-oxadiazol-5-ium-3-yl)sulfanyl]ethyl]azanium Openeye Name: dimethyl-[2-[(5-oxido-4-phenyl-1,2,5-oxadiazol-5-ium-3-yl)sulfanyl]ethyl]ammonium CAS Name: dimethyl-[2-[(5-oxido-4-phenyl-1,2,5-oxadiazol-5-ium-3-yl)thio]ethyl]ammonium IUPAC Name: dimethyl-[2-[(5-oxido-4-phenyl-1,2,5-oxadiazol-5-ium-3-yl)sulfanyl]ethyl]azanium Traditional Name: dimethyl-[2-[(5-oxido-4-phenyl-furazan-5-ium-3-yl)thio]ethyl]ammonium Formula: C12H16N3O2S+ MolecularWeight: 266.33934

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCSC1=NO[N+](=C1C2=CC=CC=C2)[O-]

Isomeric SMILES

C[NH+](C)CCSC1=NO[N+](=C1C2=CC=CC=C2)[O-]

InChI

InChI=1S/C12H15N3O2S/c1-14(2)8-9-18-12-11(15(16)17-13-12)10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3/p+1