5-(Indol-3-ylmethyl)-4-(2-methylphenyl)-1,2,4-triazole-3-thiol

Base Information

• Chemical Name: 5-(Indol-3-ylmethyl)-4-(2-methylphenyl)-1,2,4-triazole-3-thiol
• CAS No.: 7243-20-1
• Molecular Formula: C18H16N4S
• Molecular Weight: 320.4
• DSSTox Substance ID: DTXSID30413987
• Wikidata: Q82222503

Synonyms:5-(INDOL-3-YLMETHYL)-4-(2-METHYLPHENYL)-1,2,4-TRIAZOLE-3-THIOL;791717-18-5;7243-20-1;3-(1H-indol-3-ylmethyl)-4-(2-methylphenyl)-1H-1,2,4-triazole-5-thione;SCHEMBL5429851;DTXSID30413987;FPVPHGICTUFUBK-UHFFFAOYSA-N;MFCD08272817;AKOS022169683;MS-8600;5-[(1H-indol-3-yl)methyl]-4-(2-methylphenyl)-4H-1,2,4-triazole-3-thiol;5-((1H-Indol-3-yl)methyl)-4-(o-tolyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione;5-(1H-Indol-3-ylmethyl)-4-(2-methylphenyl)-2,4-dihydro-[1,2,4]triazole-3-thione

Chemical Property of 5-(Indol-3-ylmethyl)-4-(2-methylphenyl)-1,2,4-triazole-3-thiol

Chemical Property:

• Vapor Pressure: 1.53E-10mmHg at 25°C
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 320.10956770
• Heavy Atom Count: 23
• Complexity: 491

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• Canonical SMILES: CC1=CC=CC=C1N2C(=NNC2=S)CC3=CNC4=CC=CC=C43

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