Vitas-M small molecule compound
butyl 4-({2,2,2-trichloro-1-[(3-methylbutanoyl)amino]ethyl}amino)benzoate
Catalog ID
STK808760
SMILES CCCCOC(=O)c1ccc(cc1)NC(C(Cl)(Cl)Cl)NC(=O)CC(C)C
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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 C18H25Cl3N2O3 MW 423.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H25Cl3N2O3/c1-4-5-10-26-16(25)13-6-8-14(9-7-13)22-17(18(19,20)21)23-15(24)11-12(2)3/h6-9,12,17,22H,4-5,10-11H2,1-3H3,(H,23,24)InChIKey
BIFGBOBMJMYLNO-UHFFFAOYSA-NSynonyms
butyl4((222trichloro1((3methylbutanoyl)amino)ethyl)amino)benzoate
BUTYL4((222TRICHLORO1(3METHYLBUTANOYLAMINO)ETHYL)AMINO)BENZOATE
CCCCOC(=O)C1=CC=C(C=C1)NC(C(Cl)(Cl)Cl)NC(=O)CC(C)C
InChI=1SC18H25Cl3N2O3c145102616(25)136814(9713)2217(18(1920)21)2315(24)1112(2)3h69121722H451011H213H3(H2324)
MFCD00648773
ZINC000002666993
ZINC000002666994
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