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

Systemtic Name: methyl-[(2-methylphenyl)methyl]-[(5-phenyl-3-sulfanylidene-1H-1,2,4-triazol-2-yl)methyl]azanium Openeye Name: methyl-(o-tolylmethyl)-[(5-phenyl-3-thioxo-1H-1,2,4-triazol-2-yl)methyl]ammonium CAS Name: methyl-[(2-methylphenyl)methyl]-[(5-phenyl-3-sulfanylidene-1H-1,2,4-triazol-2-yl)methyl]ammonium IUPAC Name: methyl-[(2-methylphenyl)methyl]-[(5-phenyl-3-sulfanylidene-1H-1,2,4-triazol-2-yl)methyl]azanium Traditional Name: methyl-(2-methylbenzyl)-[(5-phenyl-3-thioxo-1H-1,2,4-triazol-2-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/c1-14-8-6-7-11-16(14)12-21(2)13-22-18(23)19-17(20-22)15-9-4-3-5-10-15/h3-11H,12-13H2,1-2H3,(H,19,20,23)/p+1