[5-(2-fluorophenyl)-3-sulfanylidene-1H-1,2,4-triazol-2-yl]methyl-methyl-(2-phenoxyethyl)azanium

Systemtic Name: [5-(2-fluorophenyl)-3-sulfanylidene-1H-1,2,4-triazol-2-yl]methyl-methyl-(2-phenoxyethyl)azanium Openeye Name: [5-(2-fluorophenyl)-3-thioxo-1H-1,2,4-triazol-2-yl]methyl-methyl-(2-phenoxyethyl)ammonium CAS Name: [5-(2-fluorophenyl)-3-sulfanylidene-1H-1,2,4-triazol-2-yl]methyl-methyl-(2-phenoxyethyl)ammonium IUPAC Name: [5-(2-fluorophenyl)-3-sulfanylidene-1H-1,2,4-triazol-2-yl]methyl-methyl-(2-phenoxyethyl)azanium Traditional Name: [5-(2-fluorophenyl)-3-thioxo-1H-1,2,4-triazol-2-yl]methyl-methyl-(2-phenoxyethyl)ammonium Formula: C18H20FN4OS+ MolecularWeight: 359.441003

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCOC1=CC=CC=C1)CN2C(=S)N=C(N2)C3=CC=CC=C3F

Isomeric SMILES

C[NH+](CCOC1=CC=CC=C1)CN2C(=S)N=C(N2)C3=CC=CC=C3F

InChI

InChI=1S/C18H19FN4OS/c1-22(11-12-24-14-7-3-2-4-8-14)13-23-18(25)20-17(21-23)15-9-5-6-10-16(15)19/h2-10H,11-13H2,1H3,(H,20,21,25)/p+1