Products 128196-01-0

CAS 128196-01-0 appears in our catalog under these names: (S)-Citalopram, >95% (HPLC), Escitalopram/ 94.62% (existing batch purity), Escitalopram, Escitalopram, 99.89%, Escitalopram (Standard). Offered by: TRC, TargetMol, GLPBio, Biosynth, MedChemExpress. Available pack sizes: 100mg, 10mg, 25mg, 5mg, 50mg, 250mg, 500mg, 1000mg.

Structural formula: {0} (CAS {1})

Escitalopram is a 1-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydro-2-benzofuran-5-carbonitrile that has S-configuration at the chiral centre. It is the active enantiomer of citalopram. It has a role as an antidepressant and an EC 3.4.21.26 (prolyl oligopeptidase) inhibitor. It is a conjugate base of an escitalopram(1+). It is an enantiomer of a (R)-citalopram.

Source: ChEBI

Identity
Molecular formulaC20H21FN2O
Molecular weight324.4 g/mol
IUPAC name(1S)-1-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-3H-2-benzofuran-5-carbonitrile
InChIKeyWSEQXVZVJXJVFP-FQEVSTJZSA-N
SMILESCN(C)CCC[C@@]1(C2=C(CO1)C=C(C=C2)C#N)C3=CC=C(C=C3)F

Computed by PubChem (NCBI)