Vitas-M small molecule compound
ethyl 2-[(1-{[(2-bromophenyl)carbonyl]amino}-2,2,2-trichloroethyl)amino]-4-phenylthiophene-3-carboxylate
Catalog ID
STK701558
SMILES CCOC(=O)c1c(scc1c1ccccc1)NC(C(Cl)(Cl)Cl)NC(=O)c1ccccc1Br
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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 C22H18BrCl3N2O3S MW 576.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18BrCl3N2O3S/c1-2-31-20(30)17-15(13-8-4-3-5-9-13)12-32-19(17)28-21(22(24,25)26)27-18(29)14-10-6-7-11-16(14)23/h3-12,21,28H,2H2,1H3,(H,27,29)InChIKey
ROFJZSAJLOMULO-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(C(Cl)(Cl)Cl)NC(=O)C3=CC=CC=C3Br
ethyl2((1(((2bromophenyl)carbonyl)amino)222trichloroethyl)amino)4phenylthiophene3carboxylate
ETHYL2((1((2BROMOBENZOYL)AMINO)222TRICHLOROETHYL)AMINO)4PHENYLTHIOPHENE3CARBOXYLATE
InChI=1SC22H18BrCl3N2O3Sc123120(30)1715(138435913)123219(17)2821(22(2425)26)2718(29)1410671116(14)23h3122128H2H21H3(H2729)
MFCD03461528
ZINC000002507765
ZINC000002688343
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