Vitas-M small molecule compound

(5-bromo-2-ethoxyphenyl)(pyrrolidin-1-yl)methanethione

Catalog ID
STL376403
SMILES CCOc1ccc(cc1C(=S)N1CCCC1)Br

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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 C13H16BrNOS MW 314.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16BrNOS/c1-2-16-12-6-5-10(14)9-11(12)13(17)15-7-3-4-8-15/h5-6,9H,2-4,7-8H2,1H3
InChIKey
NTDOQIYDJWFJCC-UHFFFAOYSA-N
Synonyms

(5bromo2ethoxyphenyl)(pyrrolidin1yl)methanethione
(5BROMO2ETHOXYPHENYL)PYRROLIDIN1YLMETHANETHIONE
1((5BROMO2ETHOXYPHENYL)CARBONOTHIOYL)PYRROLIDINE
CCOC1=C(C=C(C=C1)Br)C(=S)N2CCCC2
InChI=1SC13H16BrNOSc1216126510(14)911(12)13(17)15734815h569H2478H21H3
MFCD05998254
ZINC000000615552
ZINC00615552
ZINC615552

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Available files

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