Vitas-M small molecule compound

ethyl 2-[(4-butoxyphenyl)amino]-3,3,3-trifluoro-N-(phenylcarbonyl)alaninate

Catalog ID
STK691040
SMILES CCCCOc1ccc(cc1)NC(C(F)(F)F)(C(=O)OCC)NC(=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 C22H25F3N2O4 MW 438.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25F3N2O4/c1-3-5-15-31-18-13-11-17(12-14-18)26-21(22(23,24)25,20(29)30-4-2)27-19(28)16-9-7-6-8-10-16/h6-14,26H,3-5,15H2,1-2H3,(H,27,28)
InChIKey
UNSVRHWGVKLUIA-UHFFFAOYSA-N
Synonyms

CCCCOC1=CC=C(C=C1)NC(C(=O)OCC)(C(F)(F)F)NC(=O)C2=CC=CC=C2
ethyl2((4butoxyphenyl)amino)333trifluoroN(phenylcarbonyl)alaninate
ETHYL2BENZAMIDO2(4BUTOXYANILINO)333TRIFLUOROPROPANOATE
InChI=1SC22H25F3N2O4c135153118131117(121418)2621(22(2324)2520(29)3042)2719(28)1697681016h61426H3515H212H3(H2728)
MFCD03617059
PROPANOICACID2(BENZOYLAMINO)2((4BUTOXYPHENYL)AMINO)333TRIFLUOROETHYLESTER
ZINC000012410779
ZINC000012410781

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Available files

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