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

Systemtic Name: (4-ethoxyphenyl)methyl-methyl-[[5-(4-methylphenyl)-3-sulfanylidene-1H-1,2,4-triazol-2-yl]methyl]azanium Openeye Name: (4-ethoxyphenyl)methyl-methyl-[[5-(p-tolyl)-3-thioxo-1H-1,2,4-triazol-2-yl]methyl]ammonium CAS Name: (4-ethoxyphenyl)methyl-methyl-[[5-(4-methylphenyl)-3-sulfanylidene-1H-1,2,4-triazol-2-yl]methyl]ammonium IUPAC Name: (4-ethoxyphenyl)methyl-methyl-[[5-(4-methylphenyl)-3-sulfanylidene-1H-1,2,4-triazol-2-yl]methyl]azanium Traditional Name: (4-ethoxybenzyl)-methyl-[[5-(p-tolyl)-3-thioxo-1H-1,2,4-triazol-2-yl]methyl]ammonium Formula: C20H25N4OS+ MolecularWeight: 369.5037

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C[NH+](C)CN2C(=S)N=C(N2)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C[NH+](C)CN2C(=S)N=C(N2)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H24N4OS/c1-4-25-18-11-7-16(8-12-18)13-23(3)14-24-20(26)21-19(22-24)17-9-5-15(2)6-10-17/h5-12H,4,13-14H2,1-3H3,(H,21,22,26)/p+1