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

Systemtic Name: 4-[2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]morpholin-4-ium Openeye Name: 4-[2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]morpholin-4-ium CAS Name: 4-[2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)thio]ethyl]morpholin-4-ium IUPAC Name: 4-[2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]morpholin-4-ium Traditional Name: 4-[2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)thio]ethyl]morpholin-4-ium Formula: C15H21N4OS+ MolecularWeight: 305.41844

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC[NH+]2CCOCC2)C3=CC=CC=C3

Isomeric SMILES

CN1C(=NN=C1SCC[NH+]2CCOCC2)C3=CC=CC=C3

InChI

InChI=1S/C15H20N4OS/c1-18-14(13-5-3-2-4-6-13)16-17-15(18)21-12-9-19-7-10-20-11-8-19/h2-6H,7-12H2,1H3/p+1