Vitas-M small molecule compound
methyl 2-{[(1,3-benzodioxol-5-ylcarbonyl)carbamothioyl]amino}benzoate
Catalog ID
STK345795
SMILES COC(=O)c1ccccc1NC(=S)NC(=O)c1ccc2c(c1)OCO2
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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 C17H14N2O5S MW 358.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N2O5S/c1-22-16(21)11-4-2-3-5-12(11)18-17(25)19-15(20)10-6-7-13-14(8-10)24-9-23-13/h2-8H,9H2,1H3,(H2,18,19,20,25)InChIKey
IVSAEILNLUDTMQ-UHFFFAOYSA-NSynonyms
2(3(BENZO(13)DIOXOLE5CARBONYL)THIOUREIDO)BENZOICACIDMETHYLESTER
COC(=O)C1=CC=CC=C1NC(=S)NC(=O)C2=CC3=C(C=C2)OCO3
InChI=1SC17H14N2O5Sc12216(21)11423512(11)1817(25)1915(20)10671314(810)2492313h28H9H21H3(H218192025)
methyl2(((13benzodioxol5ylcarbonyl)carbamothioyl)amino)benzoate
METHYL2(13BENZODIOXOLE5CARBONYLCARBAMOTHIOYLAMINO)BENZOATE
MFCD05992590
ZINC000002860584
ZINC02860584
ZINC2860584
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