Vitas-M small molecule compound
ethyl 2-{[({2-[2-(4-bromophenyl)-2-oxoethoxy]-2-oxoethyl}sulfanyl)acetyl]amino}-1,3-benzothiazole-6-carboxylate
Catalog ID
STK279512
SMILES CCOC(=O)c1ccc2c(c1)sc(n2)NC(=O)CSCC(=O)OCC(=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 C22H19BrN2O6S2 MW 551.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19BrN2O6S2/c1-2-30-21(29)14-5-8-16-18(9-14)33-22(24-16)25-19(27)11-32-12-20(28)31-10-17(26)13-3-6-15(23)7-4-13/h3-9H,2,10-12H2,1H3,(H,24,25,27)InChIKey
FMMKISQWYGWUMH-UHFFFAOYSA-NSynonyms
311321-40-1311321401
CCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CSCC(=O)OCC(=O)C3=CC=C(C=C3)Br
ETHYL2((((2(2(4BROMOPHENYL)2OXOETHOXY)2OXOETHYL)SULFANYL)ACETYL)AMINO)13BENZOTHIAZOLE6CARBOXYLATE
ETHYL2((2(2(2(4BROMOPHENYL)2OXOETHOXY)2OXOETHYL)SULFANYLACETYL)AMINO)13BENZOTHIAZOLE6CARBOXYLATE
InChI=1SC22H19BrN2O6S2c123021(29)14581618(914)3322(2416)2519(27)11321220(28)311017(26)133615(23)7413h39H21012H21H3(H242527)
MFCD00826339
ZINC000029747804
ZINC29747804
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