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

Systemtic Name: methyl-[(2-methylphenyl)methyl]-[(4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium Openeye Name: methyl-(o-tolylmethyl)-[(4-phenyl-5-thioxo-1,2,4-triazol-1-yl)methyl]ammonium CAS Name: methyl-[(2-methylphenyl)methyl]-[(4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]ammonium IUPAC Name: methyl-[(2-methylphenyl)methyl]-[(4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium Traditional Name: methyl-(2-methylbenzyl)-[(4-phenyl-5-thioxo-1,2,4-triazol-1-yl)methyl]ammonium Formula: C18H21N4S+ MolecularWeight: 325.45114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+](C)CN2C(=S)N(C=N2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1C[NH+](C)CN2C(=S)N(C=N2)C3=CC=CC=C3

InChI

InChI=1S/C18H20N4S/c1-15-8-6-7-9-16(15)12-20(2)14-22-18(23)21(13-19-22)17-10-4-3-5-11-17/h3-11,13H,12,14H2,1-2H3/p+1