Catalog Number:
AG019EWY
Chemical Name:
2-(4-(4-(1-HYDROXYETHYL)PHENYL)-1H-1,2,3-TRIAZOL-1-YL)ACETIC ACID
CAS Number:
2035032-87-0
Molecular Formula:
C12H13N3O3
Molecular Weight:
247.2499
MDL Number:
MFCD28559206
IUPAC Name:
tert-butyl 2-[4-[[(5-amino-2,2-difluoro-5-oxopentyl)-[3-[[1-[[4-(2-amino-2-oxoethoxy)phenyl]methyl]triazol-4-yl]methylcarbamoyl]-5-[[1-(2-hydroxyethyl)triazol-4-yl]methylcarbamoyl]benzoyl]amino]methyl]triazol-1-yl]acetate
InChI:
InChI=1S/C40H48F2N14O9/c1-39(2,3)65-35(60)22-56-21-31(49-52-56)18-53(24-40(41,42)9-8-33(43)58)38(63)28-13-26(36(61)45-15-29-19-54(10-11-57)50-47-29)12-27(14-28)37(62)46-16-30-20-55(51-48-30)17-25-4-6-32(7-5-25)64-23-34(44)59/h4-7,12-14,19-21,57H,8-11,15-18,22-24H2,1-3H3,(H2,43,58)(H2,44,59)(H,45,61)(H,46,62)
InChI Key:
KTGZTXSULWKYGD-UHFFFAOYSA-N
SMILES:
OC(=O)Cn1nnc(c1)c1ccc(cc1)C(O)C
