Vitas-M small molecule compound

(4-bromo-5-ethylthiophen-2-yl)(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)methanone

Catalog ID
STK463766
SMILES CCc1sc(cc1Br)C(=O)N1CCC2(CC1)OCCO2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C14H18BrNO3S MW 360.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H18BrNO3S/c1-2-11-10(15)9-12(20-11)13(17)16-5-3-14(4-6-16)18-7-8-19-14/h9H,2-8H2,1H3
InChIKey
QNRXVHFVZUXGPW-UHFFFAOYSA-N
Synonyms

(4bromo5ethylthiophen2yl)(14dioxa8azaspiro(45)dec8yl)methanone
(4BROMO5ETHYLTHIOPHEN2YL)(14DIOXA8AZASPIRO(45)DECAN8YL)METHANONE
14DIOXA8AZASPIRO(45)DEC8YL4BROMO5ETHYL(2THIENYL)KETONE
8((4BROMO5ETHYL2THIENYL)CARBONYL)14DIOXA8AZASPIRO(45)DECANE
CCC1=C(C=C(S1)C(=O)N2CCC3(CC2)OCCO3)Br
InChI=1SC14H18BrNO3Sc121110(15)912(2011)13(17)165314(4616)18781914h9H28H21H3
MFCD06004343
ZINC000001053994
ZINC01053994
ZINC1053994

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.