N-ethyl-2-[[5-(2-piperidin-1-ium-1-ylethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-ethyl-2-[[5-(2-piperidin-1-ium-1-ylethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-allyl-5-(2-piperidin-1-ium-1-ylethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-ethyl-acetamide CAS Name: N-ethyl-2-[[5-[2-(1-piperidin-1-iumyl)ethyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-ethyl-2-[[5-(2-piperidin-1-ium-1-ylethyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[4-allyl-5-(2-piperidin-1-ium-1-ylethyl)-1,2,4-triazol-3-yl]thio]-N-ethyl-acetamide Formula: C16H28N5OS+ MolecularWeight: 338.49142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)CSC1=NN=C(N1CC=C)CC[NH+]2CCCCC2

Isomeric SMILES

CCNC(=O)CSC1=NN=C(N1CC=C)CC[NH+]2CCCCC2

InChI

InChI=1S/C16H27N5OS/c1-3-9-21-14(8-12-20-10-6-5-7-11-20)18-19-16(21)23-13-15(22)17-4-2/h3H,1,4-13H2,2H3,(H,17,22)/p+1