3-(morpholin-4-ium-4-ylmethyl)-4-phenyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(morpholin-4-ium-4-ylmethyl)-4-phenyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-(morpholin-4-ium-4-ylmethyl)-4-phenyl-1H-1,2,4-triazole-5-thione CAS Name: 3-(4-morpholin-4-iumylmethyl)-4-phenyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(morpholin-4-ium-4-ylmethyl)-4-phenyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-(morpholin-4-ium-4-ylmethyl)-4-phenyl-1H-1,2,4-triazole-5-thione Formula: C13H17N4OS+ MolecularWeight: 277.36528

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=NNC(=S)N2C3=CC=CC=C3

Isomeric SMILES

C1COCC[NH+]1CC2=NNC(=S)N2C3=CC=CC=C3

InChI

InChI=1S/C13H16N4OS/c19-13-15-14-12(10-16-6-8-18-9-7-16)17(13)11-4-2-1-3-5-11/h1-5H,6-10H2,(H,15,19)/p+1