Vitas-M small molecule compound

N-{[5-(butan-2-yl)-2-hydroxyphenyl]carbamothioyl}-2-fluorobenzamide

Catalog ID
STK172910
SMILES CCC(c1ccc(c(c1)NC(=S)NC(=O)c1ccccc1F)O)C

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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 C18H19FN2O2S MW 346.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19FN2O2S/c1-3-11(2)12-8-9-16(22)15(10-12)20-18(24)21-17(23)13-6-4-5-7-14(13)19/h4-11,22H,3H2,1-2H3,(H2,20,21,23,24)
InChIKey
PCZDEHRLCIPLFJ-UHFFFAOYSA-N
Synonyms

CCC(C)C1=CC(=C(C=C1)O)NC(=S)NC(=O)C2=CC=CC=C2F
InChI=1SC18H19FN2O2Sc1311(2)128916(22)15(1012)2018(24)2117(23)13645714(13)19h41122H3H212H3(H220212324)
MFCD02922886
N((5(BUTAN2YL)2HYDROXYPHENYL)CARBAMOTHIOYL)2FLUOROBENZAMIDE
N((5BUTAN2YL2HYDROXYPHENYL)CARBAMOTHIOYL)2FLUOROBENZAMIDE
ZINC000000456024
ZINC000000456026

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Available files

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