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

Systemtic Name: (4-fluorophenyl)methyl-methyl-[(3-methyl-4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium Openeye Name: (4-fluorophenyl)methyl-methyl-[(3-methyl-4-phenyl-5-thioxo-1,2,4-triazol-1-yl)methyl]ammonium CAS Name: (4-fluorophenyl)methyl-methyl-[(3-methyl-4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]ammonium IUPAC Name: (4-fluorophenyl)methyl-methyl-[(3-methyl-4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium Traditional Name: (4-fluorobenzyl)-methyl-[(3-methyl-4-phenyl-5-thioxo-1,2,4-triazol-1-yl)methyl]ammonium Formula: C18H20FN4S+ MolecularWeight: 343.441603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=S)N1C2=CC=CC=C2)C[NH+](C)CC3=CC=C(C=C3)F

Isomeric SMILES

CC1=NN(C(=S)N1C2=CC=CC=C2)C[NH+](C)CC3=CC=C(C=C3)F

InChI

InChI=1S/C18H19FN4S/c1-14-20-22(18(24)23(14)17-6-4-3-5-7-17)13-21(2)12-15-8-10-16(19)11-9-15/h3-11H,12-13H2,1-2H3/p+1