Vitas-M small molecule compound

2-{[5-(5-bromo-2-hydroxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-methylpiperidin-1-yl)ethanone

Catalog ID
STK243343
SMILES CC1CCN(CC1)C(=O)CSc1nnc([nH]1)c1cc(Br)ccc1O

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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 C16H19BrN4O2S MW 411.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19BrN4O2S/c1-10-4-6-21(7-5-10)14(23)9-24-16-18-15(19-20-16)12-8-11(17)2-3-13(12)22/h2-3,8,10,22H,4-7,9H2,1H3,(H,18,19,20)
InChIKey
JWSTZPJTQFFZFD-UHFFFAOYSA-N
Synonyms

2((5(5bromo2hydroxyphenyl)4H124triazol3yl)sulfanyl)1(4methylpiperidin1yl)ethanone
CC1CCN(CC1)C(=O)CSc1nnc((nH)1)c1cc(Br)ccc1O
MFCD08575626
ZINC000009295428

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Available files

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