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

Systemtic Name: N-[5-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)-1,3,4-thiadiazol-2-yl]butanamide Openeye Name: N-[5-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)-1,3,4-thiadiazol-2-yl]butanamide CAS Name: N-[5-[2-(1-pyrrolidin-1-iumyl)ethylthio]-1,3,4-thiadiazol-2-yl]butanamide IUPAC Name: N-[5-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)-1,3,4-thiadiazol-2-yl]butanamide Traditional Name: N-[5-(2-pyrrolidin-1-ium-1-ylethylthio)-1,3,4-thiadiazol-2-yl]butyramide Formula: C12H21N4OS2+ MolecularWeight: 301.45134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H20N4OS2/c1-2-5-10(17)13-11-14-15-12(19-11)18-9-8-16-6-3-4-7-16/h2-9H2,1H3,(H,13,14,17)/p+1