4-(2-fluorophenyl)-2-(morpholin-4-ium-4-ylmethyl)-1,2,4-triazole-3-thione

Systemtic Name: 4-(2-fluorophenyl)-2-(morpholin-4-ium-4-ylmethyl)-1,2,4-triazole-3-thione Openeye Name: 4-(2-fluorophenyl)-2-(morpholin-4-ium-4-ylmethyl)-1,2,4-triazole-3-thione CAS Name: 4-(2-fluorophenyl)-2-(4-morpholin-4-iumylmethyl)-1,2,4-triazole-3-thione IUPAC Name: 4-(2-fluorophenyl)-2-(morpholin-4-ium-4-ylmethyl)-1,2,4-triazole-3-thione Traditional Name: 4-(2-fluorophenyl)-2-(morpholin-4-ium-4-ylmethyl)-1,2,4-triazole-3-thione Formula: C13H16FN4OS+ MolecularWeight: 295.355743

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CN2C(=S)N(C=N2)C3=CC=CC=C3F

Isomeric SMILES

C1COCC[NH+]1CN2C(=S)N(C=N2)C3=CC=CC=C3F

InChI

InChI=1S/C13H15FN4OS/c14-11-3-1-2-4-12(11)17-9-15-18(13(17)20)10-16-5-7-19-8-6-16/h1-4,9H,5-8,10H2/p+1