2,2-dimethyl-N-[5-(2-morpholin-4-ium-4-ylethylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide

Systemtic Name: 2,2-dimethyl-N-[5-(2-morpholin-4-ium-4-ylethylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide Openeye Name: 2,2-dimethyl-N-[5-(2-morpholin-4-ium-4-ylethylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide CAS Name: 2,2-dimethyl-N-[5-[2-(4-morpholin-4-iumyl)ethylthio]-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: 2,2-dimethyl-N-[5-(2-morpholin-4-ium-4-ylethylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide Traditional Name: 2,2-dimethyl-N-[5-(2-morpholin-4-ium-4-ylethylthio)-1,3,4-thiadiazol-2-yl]propionamide Formula: C13H23N4O2S2+ MolecularWeight: 331.47732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=NN=C(S1)SCC[NH+]2CCOCC2

Isomeric SMILES

CC(C)(C)C(=O)NC1=NN=C(S1)SCC[NH+]2CCOCC2

InChI

InChI=1S/C13H22N4O2S2/c1-13(2,3)10(18)14-11-15-16-12(21-11)20-9-6-17-4-7-19-8-5-17/h4-9H2,1-3H3,(H,14,15,18)/p+1