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.

Synonyms: (1S)-1-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydro-2-benzofuran-5-carbonitrile

This is just here as a test because I lose it

Term information

Subsets

3_STAR

charge

0

database cross reference

PMID:14501259

PMID:14708881

Beilstein:9001444

PMID:24424469

PMID:24172161

PMID:24528284

PMID:18789789

LINCS:LSM-3569

CAS:128196-01-0

PMID:15609164

KEGG:D07913

HMDB:HMDB0005028

PMID:15200745

Wikipedia:Escitalopram

PMID:16266205

PMID:16937393

PMID:20825390

PMID:14594439

PMID:16953656

PMID:24469525

PMID:19710642

Drug_Central:1053

PMID:24176515

PMID:16421462

PMID:24289655

DrugBank:DB01175

formula

C20H21FN2O

has related synonym

Esertia

(S)-citalopram

(+)-citalopram

S-(+)-citalopram

S(+)-citalopram

escitalopram

escitalopramum

has obo namespace

chebi_ontology

id

CHEBI:36791

imported from

http://purl.obolibrary.org/obo/chebi.owl

inchi

InChI=1S/C20H21FN2O/c1-23(2)11-3-10-20(17-5-7-18(21)8-6-17)19-9-4-15(13-22)12-16(19)14-24-20/h4-9,12H,3,10-11,14H2,1-2H3/t20-/m0/s1

inchikey

WSEQXVZVJXJVFP-FQEVSTJZSA-N

mass

324.39202

monoisotopicmass

324.16379

smiles

CN(C)CCC[C@]1(OCc2cc(ccc12)C#N)c1ccc(F)cc1

Term relations