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

Systemtic Name: methyl-[(4-methylphenyl)methyl]-[(4-phenyl-3-pyridin-3-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium Openeye Name: methyl-[[4-phenyl-3-(3-pyridyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]-(p-tolylmethyl)ammonium CAS Name: methyl-[(4-methylphenyl)methyl]-[[4-phenyl-3-(3-pyridinyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]ammonium IUPAC Name: methyl-[(4-methylphenyl)methyl]-[(4-phenyl-3-pyridin-3-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium Traditional Name: methyl-(4-methylbenzyl)-[[4-phenyl-3-(3-pyridyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]ammonium Formula: C23H24N5S+ MolecularWeight: 402.53516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+](C)CN2C(=S)N(C(=N2)C3=CN=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+](C)CN2C(=S)N(C(=N2)C3=CN=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H23N5S/c1-18-10-12-19(13-11-18)16-26(2)17-27-23(29)28(21-8-4-3-5-9-21)22(25-27)20-7-6-14-24-15-20/h3-15H,16-17H2,1-2H3/p+1