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

Systemtic Name: (4-ethyl-5-sulfanylidene-3-thiophen-2-yl-1,2,4-triazol-1-yl)methyl-methyl-[(4-methylphenyl)methyl]azanium Openeye Name: [4-ethyl-3-(2-thienyl)-5-thioxo-1,2,4-triazol-1-yl]methyl-methyl-(p-tolylmethyl)ammonium CAS Name: (4-ethyl-5-sulfanylidene-3-thiophen-2-yl-1,2,4-triazol-1-yl)methyl-methyl-[(4-methylphenyl)methyl]ammonium IUPAC Name: (4-ethyl-5-sulfanylidene-3-thiophen-2-yl-1,2,4-triazol-1-yl)methyl-methyl-[(4-methylphenyl)methyl]azanium Traditional Name: [4-ethyl-3-(2-thienyl)-5-thioxo-1,2,4-triazol-1-yl]methyl-methyl-(4-methylbenzyl)ammonium Formula: C18H23N4S2+ MolecularWeight: 359.53202

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN(C1=S)C[NH+](C)CC2=CC=C(C=C2)C)C3=CC=CS3

Isomeric SMILES

CCN1C(=NN(C1=S)C[NH+](C)CC2=CC=C(C=C2)C)C3=CC=CS3

InChI

InChI=1S/C18H22N4S2/c1-4-21-17(16-6-5-11-24-16)19-22(18(21)23)13-20(3)12-15-9-7-14(2)8-10-15/h5-11H,4,12-13H2,1-3H3/p+1