2-(2,4-Dimethylphenyl)-3-[(1H-Tetrazol-5-Yl)Methylthio]-1H-Indole
[CAS# 66355-03-1]

Identification

• Name: 2-(2,4-Dimethylphenyl)-3-[(1H-Tetrazol-5-Yl)Methylthio]-1H-Indole
• Synonyms: 2-(2,4-Dimethylphenyl)-3-(2H-Tetrazol-5-Ylmethylthio)-1H-Indole; 2-(2,4-Dimethylphenyl)-3-(2H-1,2,3,4-Tetrazol-5-Ylmethylsulfanyl)-1H-Indole; 1H-Indole, 2-(2,4-Dimethylphenyl)-3-((1H-Tetrazol-5-Ylmethyl)Thio)-
• Molecular Formula: C₁₈H₁₇N₅S
• Molecular Weight: 335.43
• CAS Registry Number: 66355-03-1
• SMILES: C1=CC(=CC(=C1C4=C(SCC2=N[NH]N=N2)C3=CC=CC=C3[NH]4)C)C
• InChI: 1S/C18H17N5S/c1-11-7-8-13(12(2)9-11)17-18(24-10-16-20-22-23-21-16)14-5-3-4-6-15(14)19-17/h3-9,19H,10H2,1-2H3,(H,20,21,22,23)
• InChIKey: QYTWSUBGAJZYQS-UHFFFAOYSA-N

Properties

• Desity: 1.379g/cm³ (Cal.)
• Boiling point: 584.134°C at 760 mmHg (Cal.)
• Flash point: 307.074°C (Cal.)