Vitas-M small molecule compound

3-butoxy-N-[(2,5-dichlorophenyl)carbamothioyl]benzamide

Catalog ID
STK259685
SMILES CCCCOc1cccc(c1)C(=O)NC(=S)Nc1cc(Cl)ccc1Cl

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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 C18H18Cl2N2O2S MW 397.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18Cl2N2O2S/c1-2-3-9-24-14-6-4-5-12(10-14)17(23)22-18(25)21-16-11-13(19)7-8-15(16)20/h4-8,10-11H,2-3,9H2,1H3,(H2,21,22,23,25)
InChIKey
WVBNQTDWDGXGJG-UHFFFAOYSA-N
Synonyms

3butoxyN((25dichlorophenyl)carbamothioyl)benzamide
CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)Cl)Cl
InChI=1SC18H18Cl2N2O2Sc1239241464512(1014)17(23)2218(25)21161113(19)7815(16)20h481011H239H21H3(H221222325)
MFCD03991742
ZINC000002985826
ZINC02985826
ZINC2985826

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Available files

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