Vitas-M small molecule compound
butyl 4-({2,2,2-trichloro-1-[(phenylacetyl)amino]ethyl}amino)benzoate
Catalog ID
STK808837
SMILES CCCCOC(=O)c1ccc(cc1)NC(C(Cl)(Cl)Cl)NC(=O)Cc1ccccc1
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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 C21H23Cl3N2O3 MW 457.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23Cl3N2O3/c1-2-3-13-29-19(28)16-9-11-17(12-10-16)25-20(21(22,23)24)26-18(27)14-15-7-5-4-6-8-15/h4-12,20,25H,2-3,13-14H2,1H3,(H,26,27)InChIKey
MYSXMVCVWRACHZ-UHFFFAOYSA-NSynonyms
4(222TRICHLORO1PHENYLACETYLAMINOETHYLAMINO)BENZOICACIDBUTYLESTER
BUTYL4(((1R)222TRICHLORO1((PHENYLACETYL)AMINO)ETHYL)AMINO)BENZOATE
BUTYL4((222TRICHLORO1((2PHENYLACETYL)AMINO)ETHYL)AMINO)BENZOATE
butyl4((222trichloro1((phenylacetyl)amino)ethyl)amino)benzoate
CCCCOC(=O)C1=CC=C(C=C1)NC(C(Cl)(Cl)Cl)NC(=O)CC2=CC=CC=C2
InChI=1SC21H23Cl3N2O3c123132919(28)1691117(121016)2520(21(2223)24)2618(27)14157546815h4122025H231314H21H3(H2627)
MFCD00648740
ZINC000002667196
ZINC000002667197
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