Vitas-M small molecule compound

ethyl 2-[(1,3-benzodioxol-5-ylmethyl)amino]-3,3,3-trifluoro-N-(phenylcarbonyl)alaninate

Catalog ID
STL325884
SMILES CCOC(=O)C(C(F)(F)F)(NC(=O)c1ccccc1)NCc1ccc2c(c1)OCO2

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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 C20H19F3N2O5 MW 424.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19F3N2O5/c1-2-28-18(27)19(20(21,22)23,25-17(26)14-6-4-3-5-7-14)24-11-13-8-9-15-16(10-13)30-12-29-15/h3-10,24H,2,11-12H2,1H3,(H,25,26)
InChIKey
WYHVFDDBLHCEJQ-UHFFFAOYSA-N
Synonyms
372085-90-0
(S)ethyl2benzamido2((benzo(d)(13)dioxol5ylmethyl)amino)333trifluoropropanoate
2((BENZO(13)DIOXOL5YLMETHYL)AMINO)2BENZOYLAMINO333TRIFLUOROPROPIONICACIDETHYLESTER
372085900
CCOC(=O)C(C(F)(F)F)(NCC1=CC2=C(C=C1)OCO2)NC(=O)C3=CC=CC=C3
ETHYL2((13BENZODIOXOL5YLMETHYL)AMINO)2(BENZOYLAMINO)333TRIFLUOROPROPANOATE
ethyl2((13benzodioxol5ylmethyl)amino)333trifluoroN(phenylcarbonyl)alaninate
ETHYL2BENZAMIDO2(13BENZODIOXOL5YLMETHYLAMINO)333TRIFLUOROPROPANOATE
ETHYL2BENZAMIDO333TRIFLUORO2(PIPERONYLAMINO)PROPIONATE
ETHYLN(13BENZODIOXOL5YLMETHYL)2(BENZOYLAMINO)333TRIFLUORODALANINATE
InChI=1SC20H19F3N2O5c122818(27)19(20(2122)232517(26)146435714)241113891516(1013)30122915h31024H21112H21H3(H2526)
MFCD01088935
ZINC000020840387
ZINC000020840390

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Available files

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