Catalog Number:
AG01A0OP
Chemical Name:
2-{[5-(furan-2-yl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid
CAS Number:
557066-48-5
Molecular Formula:
C13H11N3O4S
Molecular Weight:
305.3091
MDL Number:
MFCD03444963
IUPAC Name:
2-[[5-(furan-2-yl)-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid
InChI:
InChI=1S/C13H11N3O4S/c17-11(18)8-21-13-15-14-12(10-4-2-6-20-10)16(13)7-9-3-1-5-19-9/h1-6H,7-8H2,(H,17,18)
InChI Key:
QIRIEGTYGKUHOB-UHFFFAOYSA-N
SMILES:
OC(=O)CSc1nnc(n1Cc1ccco1)c1ccco1
