Vitas-M small molecule compound
methyl 2-[(hexanoylcarbamothioyl)amino]benzoate
Catalog ID
STK047034
SMILES CCCCCC(=O)NC(=S)Nc1ccccc1C(=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 C15H20N2O3S MW 308.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H20N2O3S/c1-3-4-5-10-13(18)17-15(21)16-12-9-7-6-8-11(12)14(19)20-2/h6-9H,3-5,10H2,1-2H3,(H2,16,17,18,21)InChIKey
XSMUAAHGNWAWMO-UHFFFAOYSA-NSynonyms
CCCCCC(=O)NC(=S)NC1=CC=CC=C1C(=O)OC
CCCCCC(=O)NC(=S)Nc1ccccc1C(=O)OC
InChI=1SC15H20N2O3Sc13451013(18)1715(21)1612976811(12)14(19)202h69H3510H212H3(H216171821)
METHYL2(((HEXANOYLAMINO)CARBOTHIOYL)AMINO)BENZOATE
METHYL2((HEXANOYLCARBAMOTHIOYL)AMINO)BENZOATE
METHYL2(HEXANOYLCARBAMOTHIOYLAMINO)BENZOATE
MFCD02630867
STK047034
ZINC000002052145
ZINC02052145
ZINC2052145
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Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.