AC1LD9HU

ethyl 2-[[2-[[5-(furan-2-yl)-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]acetate

Also Known As: ethyl 2-{2-[5-(2-furyl)-4-(2-furylmethyl)-1,2,4-triazol-3-ylthio]acetylamino}a cetate|ethyl 2-(2-((5-(furan-2-yl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl)thio)acetamido)acetate|ethyl 2-(2-{[5-(furan-2-yl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamido)acetate|ethyl 2-[[2-[[5-(furan-2-yl)-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]acetate|ethyl N-({[5-(furan-2-yl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)glycinate

Molecular Formula	C17H18N4O5S
Molecular Weight	390.0998 g/mol
LogP	1.4
Topological Polar Surface Area	138.0 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	8
Rotatable Bonds	10
Exact Mass	390.0998
Monoisotopic Mass	390.0998
Heavy Atoms	27
Complexity	512.0

Chemical Identifiers

CAS Number	587014-29-7
SMILES	CCOC(=O)CNC(=O)CSC1=NN=C(N1CC2=CC=CO2)C3=CC=CO3
InChIKey	WBZMDMLWRBHWGK-UHFFFAOYSA-N