Analyte Name

N-[(4S)-2-[(Z)-N'-cyano-N-[3-(difluoromethoxy)phenyl]carbamimidoyl]-5-(3,4-dichlorophenyl)-3,4-dihydropyrazol-4-yl]-N-ethyl-2-hydroxyacetamide

CAS Number

1906919-67-2

Molecular Formula

C22 H20 Cl2 F2 N6 O3

Molecular Weight

525.335

Accurate Mass

524.094

SMILES

CCN([C@H]1CN(N=C1c2ccc(Cl)c(Cl)c2)\C(=N/C#N)\Nc3cccc(OC(F)F)c3)C(=O)CO

InChI

InChI=1S/C22H20Cl2F2N6O3/c1-2-31(19(34)11-33)18-10-32(30-20(18)13-6-7-16(23)17(24)8-13)22(28-12-27)29-14-4-3-5-15(9-14)35-21(25)26/h3-9,18,21,33H,2,10-11H2,1H3,(H,28,29)/t18-/m0/s1

IUPAC

N-[(4S)-2-[(Z)-N'-cyano-N-[3-(difluoromethoxy)phenyl]carbamimidoyl]-5-(3,4-dichlorophenyl)-3,4-dihydropyrazol-4-yl]-N-ethyl-2-hydroxyacetamide

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Bioactive Small Molecule

Product Format

Neat