9-(3-Methyl-2-Oxobutoxy)-7H-Furo[3,2-g][1]Benzopyran-7-One
[CAS# 4889-31-0]

Identification

• Name: 9-(3-Methyl-2-Oxobutoxy)-7H-Furo[3,2-g][1]Benzopyran-7-One
• Synonyms: 2-[[4-Amino-5-(3-Methoxyphenyl)-1,2,4-Triazol-3-Yl]Thio]-N-(4-Ethoxyphenyl)Acetamide; 2-[[4-Amino-5-(3-Methoxyphenyl)-1,2,4-Triazol-3-Yl]Sulfanyl]-N-(4-Ethoxyphenyl)Ethanamide; Zinc02389416
• Molecular Formula: C₁₉H₂₁N₅O₃S
• Molecular Weight: 399.47
• CAS Registry Number: 4889-31-0
• SMILES: C1=CC(=CC=C1NC(CSC2=NN=C([N]2N)C3=CC=CC(=C3)OC)=O)OCC
• InChI: 1S/C19H21N5O3S/c1-3-27-15-9-7-14(8-10-15)21-17(25)12-28-19-23-22-18(24(19)20)13-5-4-6-16(11-13)26-2/h4-11H,3,12,20H2,1-2H3,(H,21,25)
• InChIKey: XRQNEZNLLQXUDC-UHFFFAOYSA-N

Properties

• Density: 1.343g/cm³ (Cal.)