Catalog Number:
AG01EH82
Chemical Name:
4-(2-(4-Bromophenylthio)acetamido)-1-phenethyl-1H-pyrazole-3-carboxylic acid
CAS Number:
1021497-97-1
Molecular Formula:
C20H18BrN3O3S
Molecular Weight:
460.3442
MDL Number:
MFCD30738005
IUPAC Name:
4-[[2-(4-bromophenyl)sulfanylacetyl]amino]-1-(2-phenylethyl)pyrazole-3-carboxylic acid
InChI:
InChI=1S/C20H18BrN3O3S/c21-15-6-8-16(9-7-15)28-13-18(25)22-17-12-24(23-19(17)20(26)27)11-10-14-4-2-1-3-5-14/h1-9,12H,10-11,13H2,(H,22,25)(H,26,27)
InChI Key:
ZRLJEHIUGYTTSZ-UHFFFAOYSA-N
SMILES:
O=C(Nc1cn(nc1C(=O)O)CCc1ccccc1)CSc1ccc(cc1)Br
