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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=CC=C1)CN2C(=S)N=C(N2)C3=CC=C(C=C3)C

Isomeric SMILES

CC[NH+](CC1=CC=CC=C1)CN2C(=S)N=C(N2)C3=CC=C(C=C3)C

InChI

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