Catalog Number:
AG01A0TW
Chemical Name:
2-{[4-(4-methoxyphenyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid
CAS Number:
333408-91-6
Molecular Formula:
C16H14N4O3S
Molecular Weight:
342.3724
MDL Number:
MFCD12197027
IUPAC Name:
2-[[4-(4-methoxyphenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]acetic acid
InChI:
InChI=1S/C16H14N4O3S/c1-23-13-6-4-12(5-7-13)20-15(11-3-2-8-17-9-11)18-19-16(20)24-10-14(21)22/h2-9H,10H2,1H3,(H,21,22)
InChI Key:
XCKPYNYQYXIVMA-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)n1c(SCC(=O)O)nnc1c1cccnc1
