557069-65-5
2-((4-ETHYL-5-(2-FURYL)-4H-1,2,4-TRIAZOL-3-YL)THIO)-N-(3-METHOXYPHENYL)ACETAMIDE
Name2-((4-ETHYL-5-(2-FURYL)-4H-1,2,4-TRIAZOL-3-YL)THIO)-N-(3-METHOXYPHENYL)ACETAMIDE
1Identification
【Name】
2-((4-ETHYL-5-(2-FURYL)-4H-1,2,4-TRIAZOL-3-YL)THIO)-N-(3-METHOXYPHENYL)ACETAMIDE
【CAS】
【MDL】
MFCD03445049
【English Synonyms】
【Formula】
C17 H18 N4 O3 S
【MolWeight】
358.42
【Inchi】
InChI=1S/C17H18N4O3S/c1-3-21-16(14-8-5-9-24-14)19-20-17(21)25-11-15(22)18-12-6-4-7-13(10-12)23-2/h4-10H,3,11H2,1-2H3,(H,18,22)
【InChIKey】
InChIKey=NDWBKUDJCLPXNJ-UHFFFAOYSA-N
【SMILES】
CCn1c(nnc1SCC(=O)Nc2cccc(c2)OC)c3ccco3
【MOL File】
2-((4-ETHYL-5-(2-FUR….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-((4-ETHYL-5-(2-FURYL)-4H-1,2,4-TRIAZOL-3-YL)THIO)-N-(3-METHOXYPHENYL)ACETAMIDE.cml