2-[(4-ethyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(1-ethylpiperidin-1-ium-4-yl)ethanamide

Systemtic Name: 2-[(4-ethyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(1-ethylpiperidin-1-ium-4-yl)ethanamide Openeye Name: 2-[(4-ethyl-5-morpholino-1,2,4-triazol-3-yl)sulfanyl]-N-(1-ethylpiperidin-1-ium-4-yl)acetamide CAS Name: 2-[[4-ethyl-5-(4-morpholinyl)-1,2,4-triazol-3-yl]thio]-N-(1-ethyl-4-piperidin-1-iumyl)acetamide IUPAC Name: 2-[(4-ethyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(1-ethylpiperidin-1-ium-4-yl)acetamide Traditional Name: 2-[(4-ethyl-5-morpholino-1,2,4-triazol-3-yl)thio]-N-(1-ethylpiperidin-1-ium-4-yl)acetamide Formula: C17H31N6O2S+ MolecularWeight: 383.53204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)NC(=O)CSC2=NN=C(N2CC)N3CCOCC3

Isomeric SMILES

CC[NH+]1CCC(CC1)NC(=O)CSC2=NN=C(N2CC)N3CCOCC3

InChI

InChI=1S/C17H30N6O2S/c1-3-21-7-5-14(6-8-21)18-15(24)13-26-17-20-19-16(23(17)4-2)22-9-11-25-12-10-22/h14H,3-13H2,1-2H3,(H,18,24)/p+1