Vitas-M small molecule compound
methyl 2-[({[2-oxo-2-(2-oxo-2-phenylethoxy)ethyl]sulfanyl}acetyl)amino]-1,3-benzothiazole-6-carboxylate
Catalog ID
STK720074
SMILES COC(=O)c1ccc2c(c1)sc(n2)NC(=O)CSCC(=O)OCC(=O)c1ccccc1
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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 C21H18N2O6S2 MW 458.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N2O6S2/c1-28-20(27)14-7-8-15-17(9-14)31-21(22-15)23-18(25)11-30-12-19(26)29-10-16(24)13-5-3-2-4-6-13/h2-9H,10-12H2,1H3,(H,22,23,25)InChIKey
ZZOOPUKAVKKTKA-UHFFFAOYSA-NSynonyms
2OXO2PHENYLETHYL2((N(6(METHOXYCARBONYL)BENZOTHIAZOL2YL)CARBAMOYL)METHYLTHIO)ACETATE
COC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CSCC(=O)OCC(=O)C3=CC=CC=C3
InChI=1SC21H18N2O6S2c12820(27)14781517(914)3121(2215)2318(25)11301219(26)291016(24)135324613h29H1012H21H3(H222325)
methyl2((((2oxo2(2oxo2phenylethoxy)ethyl)sulfanyl)acetyl)amino)13benzothiazole6carboxylate
METHYL2((((2OXO2(2OXO2PHENYLETHOXY)ETHYL)THIO)ACETYL)AMINO)13BENZOTHIAZOLE6CARBOXYLATE
METHYL2((2(2OXO2PHENACYLOXYETHYL)SULFANYLACETYL)AMINO)13BENZOTHIAZOLE6CARBOXYLATE
MFCD00824412
ZINC000003117199
ZINC03117199
ZINC3117199
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