Vitas-M small molecule compound

methyl 3-({[2-(formylamino)tricyclo[3.3.1.1~3,7~]dec-2-yl]carbonyl}amino)benzoate

Catalog ID
STK507426
SMILES O=CNC1(C2CC3CC1CC(C2)C3)C(=O)Nc1cccc(c1)C(=O)OC

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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 C20H24N2O4 MW 356.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N2O4/c1-26-18(24)14-3-2-4-17(10-14)22-19(25)20(21-11-23)15-6-12-5-13(8-15)9-16(20)7-12/h2-4,10-13,15-16H,5-9H2,1H3,(H,21,23)(H,22,25)
InChIKey
FYEMDKCACREOCH-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CC(=CC=C1)NC(=O)C2(C3CC4CC(C3)CC2C4)NC=O
InChI=1SC20H24N2O4c12618(24)1432417(1014)2219(25)20(211123)15612513(815)916(20)712h2410131516H59H21H3(H2123)(H2225)
METHYL3(((2(FORMYLAMINO)2ADAMANTYL)CARBONYL)AMINO)BENZOATE
methyl3(((2(formylamino)tricyclo(3311~37~)dec2yl)carbonyl)amino)benzoate
methyl3((2formamidoadamantane2carbonyl)amino)benzoate
MFCD13369357
ZINC000015414387
ZINC15414387

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Available files

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