3-[1,1-bis(oxidanylidene)-1,4-thiazinan-4-ium-4-yl]propanenitrile

Systemtic Name: 3-[1,1-bis(oxidanylidene)-1,4-thiazinan-4-ium-4-yl]propanenitrile Openeye Name: 3-(1,1-dioxo-1,4-thiazinan-4-ium-4-yl)propanenitrile CAS Name: 3-(1,1-dioxo-1,4-thiazinan-4-ium-4-yl)propanenitrile IUPAC Name: 3-(1,1-dioxo-1,4-thiazinan-4-ium-4-yl)propanenitrile Traditional Name: 3-(1,1-diketo-1,4-thiazinan-4-ium-4-yl)propionitrile Formula: C7H13N2O2S+ MolecularWeight: 189.25532

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC[NH+]1CCC#N

Isomeric SMILES

C1CS(=O)(=O)CC[NH+]1CCC#N

InChI

InChI=1S/C7H12N2O2S/c8-2-1-3-9-4-6-12(10,11)7-5-9/h1,3-7H2/p+1