Vitas-M small molecule compound
4-tert-butyl-N-(2,6-dimethylphenyl)-1-{[2-(2,4,5-trichlorophenoxy)propanoyl]amino}cyclohexanecarboxamide
Catalog ID
STK071430
SMILES O=C(C(Oc1cc(Cl)c(cc1Cl)Cl)C)NC1(CCC(CC1)C(C)(C)C)C(=O)Nc1c(C)cccc1C
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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 C28H35Cl3N2O3 MW 553.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H35Cl3N2O3/c1-16-8-7-9-17(2)24(16)32-26(35)28(12-10-19(11-13-28)27(4,5)6)33-25(34)18(3)36-23-15-21(30)20(29)14-22(23)31/h7-9,14-15,18-19H,10-13H2,1-6H3,(H,32,35)(H,33,34)InChIKey
MRSSSNSMPYZHFZ-UHFFFAOYSA-NSynonyms
4TERTBUTYLN(26DIMETHYLPHENYL)1((2(245TRICHLOROPHENOXY)PROPANOYL)AMINO)CYCLOHEXANECARBOXAMIDE
4TERTBUTYLN(26DIMETHYLPHENYL)1(2(245TRICHLOROPHENOXY)PROPANOYLAMINO)CYCLOHEXANE1CARBOXAMIDE
CC1=C(C(=CC=C1)C)NC(=O)C2(CCC(CC2)C(C)(C)C)NC(=O)C(C)OC3=CC(=C(C=C3Cl)Cl)Cl
InChI=1SC28H35Cl3N2O3c11687917(2)24(16)3226(35)28(121019(111328)27(45)6)3325(34)18(3)36231521(30)20(29)1422(23)31h7914151819H1013H216H3(H3235)(H3334)
MFCD00993773
O=C(C(Oc1cc(Cl)c(cc1Cl)Cl)C)NC1(CCC(CC1)C(C)(C)C)C(=O)Nc1c(C)cccc1C
STK071430
ZINC000097997036
ZINC000097997037
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