4-ethyl-2-(morpholin-4-ium-4-ylmethyl)-5-thiophen-2-yl-1,2,4-triazole-3-thione

Systemtic Name: 4-ethyl-2-(morpholin-4-ium-4-ylmethyl)-5-thiophen-2-yl-1,2,4-triazole-3-thione Openeye Name: 4-ethyl-2-(morpholin-4-ium-4-ylmethyl)-5-(2-thienyl)-1,2,4-triazole-3-thione CAS Name: 4-ethyl-2-(4-morpholin-4-iumylmethyl)-5-thiophen-2-yl-1,2,4-triazole-3-thione IUPAC Name: 4-ethyl-2-(morpholin-4-ium-4-ylmethyl)-5-thiophen-2-yl-1,2,4-triazole-3-thione Traditional Name: 4-ethyl-2-(morpholin-4-ium-4-ylmethyl)-5-(2-thienyl)-1,2,4-triazole-3-thione Formula: C13H19N4OS2+ MolecularWeight: 311.44616

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN(C1=S)C[NH+]2CCOCC2)C3=CC=CS3

Isomeric SMILES

CCN1C(=NN(C1=S)C[NH+]2CCOCC2)C3=CC=CS3

InChI

InChI=1S/C13H18N4OS2/c1-2-16-12(11-4-3-9-20-11)14-17(13(16)19)10-15-5-7-18-8-6-15/h3-4,9H,2,5-8,10H2,1H3/p+1