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

Systemtic Name: 2,2-dimethyl-N-[5-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide Openeye Name: 2,2-dimethyl-N-[5-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide CAS Name: 2,2-dimethyl-N-[5-[2-(1-pyrrolidin-1-iumyl)ethylthio]-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: 2,2-dimethyl-N-[5-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide Traditional Name: 2,2-dimethyl-N-[5-(2-pyrrolidin-1-ium-1-ylethylthio)-1,3,4-thiadiazol-2-yl]propionamide Formula: C13H23N4OS2+ MolecularWeight: 315.47792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=NN=C(S1)SCC[NH+]2CCCC2

Isomeric SMILES

CC(C)(C)C(=O)NC1=NN=C(S1)SCC[NH+]2CCCC2

InChI

InChI=1S/C13H22N4OS2/c1-13(2,3)10(18)14-11-15-16-12(20-11)19-9-8-17-6-4-5-7-17/h4-9H2,1-3H3,(H,14,15,18)/p+1