Vitas-M small molecule compound
methyl 2-[(1-{[(4-bromophenyl)carbonyl]amino}-2,2,2-trichloroethyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK726709
SMILES COC(=O)c1c(sc2c1CCCC2)NC(C(Cl)(Cl)Cl)NC(=O)c1ccc(cc1)Br
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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 C19H18BrCl3N2O3S MW 540.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18BrCl3N2O3S/c1-28-17(27)14-12-4-2-3-5-13(12)29-16(14)25-18(19(21,22)23)24-15(26)10-6-8-11(20)9-7-10/h6-9,18,25H,2-5H2,1H3,(H,24,26)InChIKey
QMLBZCZIOJCICN-UHFFFAOYSA-NSynonyms
324073-40-7324073407
COC(=O)C1=C(SC2=C1CCCC2)NC(C(Cl)(Cl)Cl)NC(=O)C3=CC=C(C=C3)Br
InChI=1SC19H18BrCl3N2O3Sc12817(27)1412423513(12)2916(14)2518(19(2122)23)2415(26)106811(20)9710h691825H25H21H3(H2426)
methyl2((1(((4bromophenyl)carbonyl)amino)222trichloroethyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((1((4bromobenzoyl)amino)222trichloroethyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((1(4bromobenzamido)222trichloroethyl)amino)4567tetrahydrobenzo(b)thiophene3carboxylate
MFCD00615991
ZINC000002270699
ZINC000002270700
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