Catalog Number:
AG019JWS
Chemical Name:
2-[(4-benzyl-5-cyclopropyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetic acid
CAS Number:
852400-25-0
Molecular Formula:
C14H15N3O2S
Molecular Weight:
289.3528
MDL Number:
MFCD06655083
IUPAC Name:
2-[(4-benzyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]acetic acid
InChI:
InChI=1S/C14H15N3O2S/c18-12(19)9-20-14-16-15-13(11-6-7-11)17(14)8-10-4-2-1-3-5-10/h1-5,11H,6-9H2,(H,18,19)
InChI Key:
WKPKUAGYCXDNLS-UHFFFAOYSA-N
SMILES:
OC(=O)CSc1nnc(n1Cc1ccccc1)C1CC1
