Catalog Number:
AG0082NE
Chemical Name:
Fluconazole-d4
CAS Number:
1124197-58-5
Molecular Formula:
C13H8D4F2N6O
Molecular Weight:
310.2954
MDL Number:
MFCD06658757
IUPAC Name:
1,1,3,3-tetradeuterio-2-(2,4-difluorophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol
InChI:
InChI=1S/C13H12F2N6O/c14-10-1-2-11(12(15)3-10)13(22,4-20-8-16-6-18-20)5-21-9-17-7-19-21/h1-3,6-9,22H,4-5H2/i4D2,5D2
InChI Key:
RFHAOTPXVQNOHP-CQOLUAMGSA-N
SMILES:
Fc1ccc(c(c1)F)C(C(n1cncn1)([2H])[2H])(C(n1cncn1)([2H])[2H])O
