Vitas-M small molecule compound

3-(3,5-di-tert-butyl-4-hydroxyphenyl)-N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-(4-methylphenyl)-2-oxoethyl]-N-methylpropanamide

Catalog ID
STK149213
SMILES Cc1ccc(cc1)C(N(C(=O)CCc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)C)C(=O)Nc1ccc2c(c1)OCCO2

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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 C35H44N2O5 MW 572.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H44N2O5/c1-22-9-12-24(13-10-22)31(33(40)36-25-14-15-28-29(21-25)42-18-17-41-28)37(8)30(38)16-11-23-19-26(34(2,3)4)32(39)27(20-23)35(5,6)7/h9-10,12-15,19-21,31,39H,11,16-18H2,1-8H3,(H,36,40)
InChIKey
FLGSPSVULHTOSW-UHFFFAOYSA-N
Synonyms

3(35DITERTBUTYL4HYDROXYPHENYL)N(2(23DIHYDRO14BENZODIOXIN6YLAMINO)1(4METHYLPHENYL)2OXOETHYL)NMETHYLPROPANAMIDE
CC1=CC=C(C=C1)C(C(=O)NC2=CC3=C(C=C2)OCCO3)N(C)C(=O)CCC4=CC(=C(C(=C4)C(C)(C)C)O)C(C)(C)C
InChI=1SC35H44N2O5c12291224(131022)31(33(40)362514152829(2125)4218174128)37(8)30(38)1611231926(34(23)4)32(39)27(2023)35(56)7h910121519213139H111618H218H3(H3640)
MFCD03449744
ZINC000003614811
ZINC000003614814

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Available files

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