4-(2-methylphenyl)-3-tridecyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(2-methylphenyl)-3-tridecyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-(o-tolyl)-3-tridecyl-1H-1,2,4-triazole-5-thione CAS Name: 4-(2-methylphenyl)-3-tridecyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(2-methylphenyl)-3-tridecyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-(o-tolyl)-3-tridecyl-1H-1,2,4-triazole-5-thione Formula: C22H35N3S MolecularWeight: 373.5984

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC1=NNC(=S)N1C2=CC=CC=C2C

Isomeric SMILES

CCCCCCCCCCCCCC1=NNC(=S)N1C2=CC=CC=C2C

InChI

InChI=1S/C22H35N3S/c1-3-4-5-6-7-8-9-10-11-12-13-18-21-23-24-22(26)25(21)20-17-15-14-16-19(20)2/h14-17H,3-13,18H2,1-2H3,(H,24,26)