Vitas-M small molecule compound

N-[(5-bromo-6-methylpyridin-2-yl)carbamothioyl]-3-butoxybenzamide

Catalog ID
STK240649
SMILES CCCCOc1cccc(c1)C(=O)NC(=S)Nc1ccc(c(n1)C)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 C18H20BrN3O2S MW 422.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20BrN3O2S/c1-3-4-10-24-14-7-5-6-13(11-14)17(23)22-18(25)21-16-9-8-15(19)12(2)20-16/h5-9,11H,3-4,10H2,1-2H3,(H2,20,21,22,23,25)
InChIKey
OLXAOQSRGQDMED-UHFFFAOYSA-N
Synonyms

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=NC(=C(C=C2)Br)C
InChI=1SC18H20BrN3O2Sc13410241475613(1114)17(23)2218(25)21169815(19)12(2)2016h5911H3410H212H3(H22021222325)
MFCD03909862
N((5bromo6methylpyridin2yl)carbamothioyl)3butoxybenzamide
ZINC000005946310
ZINC05946310
ZINC5946310

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Available files

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