Vitas-M small molecule compound

methyl {4-[(cyclohexylcarbamothioyl)amino]phenyl}acetate

Catalog ID
STK142730
SMILES COC(=O)Cc1ccc(cc1)NC(=S)NC1CCCCC1

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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 C16H22N2O2S MW 306.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22N2O2S/c1-20-15(19)11-12-7-9-14(10-8-12)18-16(21)17-13-5-3-2-4-6-13/h7-10,13H,2-6,11H2,1H3,(H2,17,18,21)
InChIKey
BMLLTDIGOHTEDH-UHFFFAOYSA-N
Synonyms
516457-01-5
516457015
COC(=O)CC1=CC=C(C=C1)NC(=S)NC2CCCCC2
InChI=1SC16H22N2O2Sc12015(19)11127914(10812)1816(21)17135324613h71013H2611H21H3(H2171821)
METHYL(4((CYCLOHEXYLCARBAMOTHIOYL)AMINO)PHENYL)ACETATE
methyl2(4(3cyclohexylthioureido)phenyl)acetate
METHYL2(4(CYCLOHEXYLCARBAMOTHIOYLAMINO)PHENYL)ACETATE
MFCD03760020
ZINC000000542409
ZINC00542409
ZINC542409

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Available files

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