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

Systemtic Name: 4-[2-[(4-ethyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethyl]morpholin-4-ium Openeye Name: 4-[2-[[4-ethyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]ethyl]morpholin-4-ium CAS Name: 4-[2-[[4-ethyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]ethyl]morpholin-4-ium IUPAC Name: 4-[2-[(4-ethyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethyl]morpholin-4-ium Traditional Name: 4-[2-[[4-ethyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]ethyl]morpholin-4-ium Formula: C15H22N5OS+ MolecularWeight: 320.43308

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC[NH+]2CCOCC2)C3=CN=CC=C3

Isomeric SMILES

CCN1C(=NN=C1SCC[NH+]2CCOCC2)C3=CN=CC=C3

InChI

InChI=1S/C15H21N5OS/c1-2-20-14(13-4-3-5-16-12-13)17-18-15(20)22-11-8-19-6-9-21-10-7-19/h3-5,12H,2,6-11H2,1H3/p+1