Vitas-M small molecule compound
ethyl 2-({[(5-bromofuran-2-yl)carbonyl]carbamothioyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK120380
SMILES CCOC(=O)c1c(NC(=S)NC(=O)c2ccc(o2)Br)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 C17H17BrN2O4S2 MW 457.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17BrN2O4S2/c1-2-23-16(22)13-9-5-3-4-6-11(9)26-15(13)20-17(25)19-14(21)10-7-8-12(18)24-10/h7-8H,2-6H2,1H3,(H2,19,20,21,25)InChIKey
QQKKZQRYIBAASH-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=S)NC(=O)C3=CC=C(O3)Br
ethyl2((((5bromofuran2yl)carbonyl)carbamothioyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((5bromofuran2carbonyl)carbamothioylamino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC17H17BrN2O4S2c122316(22)139534611(9)2615(13)2017(25)1914(21)107812(18)2410h78H26H21H3(H219202125)
MFCD03589031
ZINC000000676402
ZINC00676402
ZINC676402
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