N-[5-(2-piperidin-1-ium-1-ylethyl)-1,3,4-thiadiazol-2-yl]pyridine-3-carboxamide

Systemtic Name: N-[5-(2-piperidin-1-ium-1-ylethyl)-1,3,4-thiadiazol-2-yl]pyridine-3-carboxamide Openeye Name: N-[5-(2-piperidin-1-ium-1-ylethyl)-1,3,4-thiadiazol-2-yl]pyridine-3-carboxamide CAS Name: N-[5-[2-(1-piperidin-1-iumyl)ethyl]-1,3,4-thiadiazol-2-yl]-3-pyridinecarboxamide IUPAC Name: N-[5-(2-piperidin-1-ium-1-ylethyl)-1,3,4-thiadiazol-2-yl]pyridine-3-carboxamide Traditional Name: N-[5-(2-piperidin-1-ium-1-ylethyl)-1,3,4-thiadiazol-2-yl]nicotinamide Formula: C15H20N5OS+ MolecularWeight: 318.4172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCC2=NN=C(S2)NC(=O)C3=CN=CC=C3

Isomeric SMILES

C1CC[NH+](CC1)CCC2=NN=C(S2)NC(=O)C3=CN=CC=C3

InChI

InChI=1S/C15H19N5OS/c21-14(12-5-4-7-16-11-12)17-15-19-18-13(22-15)6-10-20-8-2-1-3-9-20/h4-5,7,11H,1-3,6,8-10H2,(H,17,19,21)/p+1