Vitas-M small molecule compound

methyl 4-({[(naphthalen-2-yloxy)acetyl]carbamothioyl}amino)benzoate

Catalog ID
STK006837
SMILES COC(=O)c1ccc(cc1)NC(=S)NC(=O)COc1ccc2c(c1)cccc2

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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 C21H18N2O4S MW 394.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N2O4S/c1-26-20(25)15-6-9-17(10-7-15)22-21(28)23-19(24)13-27-18-11-8-14-4-2-3-5-16(14)12-18/h2-12H,13H2,1H3,(H2,22,23,24,28)
InChIKey
VUODQQYRMAWIEI-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)COC2=CC3=CC=CC=C3C=C2
COC(=O)c1ccc(cc1)NC(=S)NC(=O)COc1ccc2c(c1)cccc2
InChI=1SC21H18N2O4Sc12620(25)156917(10715)2221(28)2319(24)13271811814423516(14)1218h212H13H21H3(H222232428)
METHYL4((((NAPHTHALEN2YLOXY)ACETYL)CARBAMOTHIOYL)AMINO)BENZOATE
METHYL4((2NAPHTHALEN2YLOXYACETYL)CARBAMOTHIOYLAMINO)BENZOATE
MFCD03177694
STK006837
ZINC000004550557
ZINC04550557
ZINC4550557

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Available files

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