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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C=NN(C2=S)C[NH+](C)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C=NN(C2=S)C[NH+](C)CC3=CC=CC=C3

InChI

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