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

Systemtic Name: cyclopropyl-[(4-ethyl-5-sulfanylidene-3-thiophen-2-yl-1,2,4-triazol-1-yl)methyl]-[(4-fluorophenyl)methyl]azanium Openeye Name: cyclopropyl-[[4-ethyl-3-(2-thienyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]-[(4-fluorophenyl)methyl]ammonium CAS Name: cyclopropyl-[(4-ethyl-5-sulfanylidene-3-thiophen-2-yl-1,2,4-triazol-1-yl)methyl]-[(4-fluorophenyl)methyl]ammonium IUPAC Name: cyclopropyl-[(4-ethyl-5-sulfanylidene-3-thiophen-2-yl-1,2,4-triazol-1-yl)methyl]-[(4-fluorophenyl)methyl]azanium Traditional Name: cyclopropyl-[[4-ethyl-3-(2-thienyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]-(4-fluorobenzyl)ammonium Formula: C19H22FN4S2+ MolecularWeight: 389.533183

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN(C1=S)C[NH+](CC2=CC=C(C=C2)F)C3CC3)C4=CC=CS4

Isomeric SMILES

CCN1C(=NN(C1=S)C[NH+](CC2=CC=C(C=C2)F)C3CC3)C4=CC=CS4

InChI

InChI=1S/C19H21FN4S2/c1-2-23-18(17-4-3-11-26-17)21-24(19(23)25)13-22(16-9-10-16)12-14-5-7-15(20)8-6-14/h3-8,11,16H,2,9-10,12-13H2,1H3/p+1