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

Systemtic Name: [5-(4-ethylphenyl)-3-sulfanylidene-1H-1,2,4-triazol-2-yl]methyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[[5-(4-ethylphenyl)-3-thioxo-1H-1,2,4-triazol-2-yl]methyl]-methyl-ammonium CAS Name: [5-(4-ethylphenyl)-3-sulfanylidene-1H-1,2,4-triazol-2-yl]methyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[[5-(4-ethylphenyl)-3-sulfanylidene-1H-1,2,4-triazol-2-yl]methyl]-methylazanium Traditional Name: benzyl-[[5-(4-ethylphenyl)-3-thioxo-1H-1,2,4-triazol-2-yl]methyl]-methyl-ammonium Formula: C19H23N4S+ MolecularWeight: 339.47772

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=S)N(N2)C[NH+](C)CC3=CC=CC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=S)N(N2)C[NH+](C)CC3=CC=CC=C3

InChI

InChI=1S/C19H22N4S/c1-3-15-9-11-17(12-10-15)18-20-19(24)23(21-18)14-22(2)13-16-7-5-4-6-8-16/h4-12H,3,13-14H2,1-2H3,(H,20,21,24)/p+1