Substance
  • Substance Name: bicalutamide
  • Formula: C18H14F4N2O4S
  • Molecular Weight: 430.4 g/mol
  • Identifiers:
    • casrn: 90357-06-5
    • pubchemId: 2375
    • iupacname: N-[4-cyano-3-(trifluoromethyl)phenyl]-3-(4-fluorophenyl)sulfonyl-2-hydroxy-2-methylpropanamide
    • inchi: InChI=1S/C18H14F4N2O4S/c1-17(26,10-29(27,28)14-6-3-12(19)4-7-14)16(25)24-13-5-2-11(9-23)15(8-13)18(20,21)22/h2-8,26H,10H2,1H3,(H,24,25)
    • inchikey: LKJPYSCBVHEWIU-UHFFFAOYSA-N
    • csmiles: CC(CS(=O)(=O)C1=CC=C(C=C1)F)(C(=O)NC2=CC(=C(C=C2)C#N)C(F)(F)F)O
    • ismiles: CC(CS(=O)(=O)C1=CC=C(C=C1)F)(C(=O)NC2=CC(=C(C=C2)C#N)C(F)(F)F)O
    • wikidataId: Q1988832
    • chemspiderId: 2284
    • dsstoxcmpId: DTXCID20820065
    • chemblId: CHEMBL409
    • ecnumber: 618-534-3
bicalutamide
Systems and Datasets