EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:42359 - (3R)-3-(fluoromethyl)-7-(thiomorpholin-4-ylsulfonyl)-1,2,3,4-tetrahydroisoquinoline

ChEBI IDCHEBI:42359
ChEBI Name(3R)-3-(fluoromethyl)-7-(thiomorpholin-4-ylsulfonyl)-1,2,3,4-tetrahydroisoquinoline
Stars
ASCII Name(3R)-3-(fluoromethyl)-7-(thiomorpholin-4-ylsulfonyl)-1,2,3,4-tetrahydroisoquinoline
Last Modified17 October 2009
DownloadsMolfile
FormulaC14H19FN2O2S2
Net Charge0
Average Mass330.450
Monoisotopic Mass330.08720
SMILES[H]c1c([H])c(S(=O)(=O)N2C([H])([H])C([H])([H])SC([H])([H])C2([H])[H])c([H])c2c1C([H])([H])[C@]([H])(C([H])([H])F)N([H])C2([H])[H]
InChIInChI=1S/C14H19FN2O2S2/c15-9-13-7-11-1-2-14(8-12(11)10-16-13)21(18,19)17-3-5-20-6-4-17/h1-2,8,13,16H,3-7,9-10H2/t13-/m1/s1
InChIKeySBUKSNPHYWXCDG-CYBMUJFWSA-N
ChEBI Ontology
Outgoing Relation(s)
(3R)-3-(fluoromethyl)-7-(thiomorpholin-4-ylsulfonyl)-1,2,3,4-tetrahydroisoquinoline (CHEBI:42359) is a isoquinolines (CHEBI:24922)
(3R)-3-(fluoromethyl)-7-(thiomorpholin-4-ylsulfonyl)-1,2,3,4-tetrahydroisoquinoline (CHEBI:42359) is a organofluorine compound (CHEBI:37143)
(3R)-3-(fluoromethyl)-7-(thiomorpholin-4-ylsulfonyl)-1,2,3,4-tetrahydroisoquinoline (CHEBI:42359) is a sulfonamide (CHEBI:35358)
(3R)-3-(fluoromethyl)-7-(thiomorpholin-4-ylsulfonyl)-1,2,3,4-tetrahydroisoquinoline (CHEBI:42359) is a thiomorpholines (CHEBI:36393)
Synonyms  Source
(3R)-3-(FLUOROMETHYL)-7-(THIOMORPHOLIN-4-YLSULFONYL)-1,2,3,4-TETRAHYDROISOQUINOLINEPDBeChem
(3R)-3-(fluoromethyl)-7-(thiomorpholin-4-ylsulfonyl)-1,2,3,4-tetrahydroisoquinolinePDBeChem
Manual XrefsDatabases
F21PDBeChem