Vitas-M small molecule compound
ethyl 2-({[(2E)-3-(furan-2-yl)prop-2-enoyl]carbamothioyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK391157
SMILES CCOC(=O)c1c(NC(=S)NC(=O)/C=C/c2ccco2)sc2c1CCCC2
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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 C19H20N2O4S2 MW 404.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2O4S2/c1-2-24-18(23)16-13-7-3-4-8-14(13)27-17(16)21-19(26)20-15(22)10-9-12-6-5-11-25-12/h5-6,9-11H,2-4,7-8H2,1H3,(H2,20,21,22,26)/b10-9+InChIKey
WLPIAVWEEOOKDV-MDZDMXLPSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=S)NC(=O)C=CC3=CC=CO3
CCOC(=O)c1c(NC(=S)NC(=O)C=Cc2ccco2)sc2c1CCCC2
ethyl2((((2E)3(furan2yl)prop2enoyl)carbamothioyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2(((E)3(furan2yl)prop2enoyl)carbamothioylamino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC19H20N2O4S2c122418(23)1613734814(13)2717(16)2119(26)2015(22)1091265112512h56911H2478H21H3(H220212226)b109+
MFCD00361016
ZINC000001232383
ZINC01232383
ZINC1232383
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