(5-oxidanylidene-4-propyl-2H-1,2,5-oxadiazol-5-ium-3-yl)methanethiol

Systemtic Name: (5-oxidanylidene-4-propyl-2H-1,2,5-oxadiazol-5-ium-3-yl)methanethiol Openeye Name: (5-oxo-4-propyl-2H-1,2,5-oxadiazol-5-ium-3-yl)methanethiol CAS Name: (5-oxo-4-propyl-2H-1,2,5-oxadiazol-5-ium-3-yl)methanethiol IUPAC Name: (5-oxo-4-propyl-2H-1,2,5-oxadiazol-5-ium-3-yl)methanethiol Traditional Name: (5-keto-4-propyl-2H-furazan-5-ium-3-yl)methanethiol Formula: C6H11N2O2S+ MolecularWeight: 175.22874

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(NO[N+]1=O)CS

Isomeric SMILES

CCCC1=C(NO[N+]1=O)CS

InChI

InChI=1S/C6H10N2O2S/c1-2-3-6-5(4-11)7-10-8(6)9/h7H,2-4H2,1H3/p+1