Vioxx
Molecular Formula:
C
17
H
14
O
4
S
InChI:
InChI=1/C17H14O4S/c1-22(19,20)14-9-7-12(8-10-14)15-11-21-17(18)16(15)13-5-3-2-4-6-13/h2-10H,11H2,1H3
InChIKey:
InChIKey=RZJQGNCSTQAWON-UHFFFAOYAR
SMILES:
CS(=O)(=O)c1ccc(cc1)C2=C(C(=O)OC2)c3ccccc3
CAS number 162011-90-7
Names:
Ceoxx
KBio2_007481
Rofecoxib
rofecoxib
Vioxx
3-phenyl-4-[4-(methylsulfonyl)phenyl]-2(5H)-furanone
4-(4-methylsulfonylphenyl)-3-phenyl-5H-furan-2-one
4-[4-(methylsulfonyl)phenyl]-3-phenyl-2(5H)-furanone
Registries:
PubChem CID 5090
Beilstein =8269007
CAS 162011-90-7 (from NIST)
ChEBI 8887
Kegg C07590
PubChem ID 11369881
PubChem ID 9792