Vitas-M small molecule compound

methyl 2-{[(naphthalen-1-ylacetyl)carbamothioyl]amino}benzoate

Catalog ID
STK324342
SMILES COC(=O)c1ccccc1NC(=S)NC(=O)Cc1cccc2c1cccc2

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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 C21H18N2O3S MW 378.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N2O3S/c1-26-20(25)17-11-4-5-12-18(17)22-21(27)23-19(24)13-15-9-6-8-14-7-2-3-10-16(14)15/h2-12H,13H2,1H3,(H2,22,23,24,27)
InChIKey
FHGAOKYSPGAXRX-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CC=CC=C1NC(=S)NC(=O)CC2=CC=CC3=CC=CC=C32
InChI=1SC21H18N2O3Sc12620(25)1711451218(17)2221(27)2319(24)1315968147231016(14)15h212H13H21H3(H222232427)
methyl2(((naphthalen1ylacetyl)carbamothioyl)amino)benzoate
METHYL2((2NAPHTHALEN1YLACETYL)CARBAMOTHIOYLAMINO)BENZOATE
MFCD05655265
ZINC000007274646
ZINC07274646
ZINC7274646

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Available files

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