2,3-dihydro-2-spiro[1-(benzyl)piperidin-4-yl]-1,3-benzothiazole (CHEBI:228736)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	2,3-dihydro-2-spiro[1-(benzyl)piperidin-4-yl]-1,3-benzothiazole

ChEBI ID	CHEBI:228736

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C18H20N2S

Net Charge

Average Mass

296.430

Monoisotopic Mass

296.13472

InChI

InChI=1S/C18H20N2S/c1-2-6-15(7-3-1)14-20-12-10-18(11-13-20)19-16-8-4-5-9-17(16)21-18/h1-9,19H,10-14H2

InChIKey

VNSVQTGIKLTTQJ-UHFFFAOYSA-N

SMILES

S1C2(NC=3C1=CC=CC3)CCN(CC2)CC4=CC=CC=C4

Metabolite of Species	Details
Homo sapiens (NCBI:txid9606)	Found in urine (BTO:0001419). See: MetaboLights Study

ChEBI Ontology
Outgoing	2,3-dihydro-2-spiro[1-(benzyl)piperidin-4-yl]-1,3-benzothiazole (CHEBI:228736) is a piperidines (CHEBI:26151)

IUPAC Name

1'-benzylspiro[3H-1,3-benzothiazole-2,4'-piperidine]