Vitas-M small molecule compound

N-(2,5-dimethylphenyl)-4-hydroxy-3,6,6-trimethyl-4,5,6,7-tetrahydro-1-benzofuran-2-carboxamide

Catalog ID
STL237019
SMILES Cc1ccc(c(c1)NC(=O)c1oc2c(c1C)C(O)CC(C2)(C)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 C20H25NO3 MW 327.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25NO3/c1-11-6-7-12(2)14(8-11)21-19(23)18-13(3)17-15(22)9-20(4,5)10-16(17)24-18/h6-8,15,22H,9-10H2,1-5H3,(H,21,23)
InChIKey
AWAQRQQPUHBJRO-UHFFFAOYSA-N
Synonyms
879803-26-6
879803266
CC1=CC(=C(C=C1)C)NC(=O)C2=C(C3=C(O2)CC(CC3O)(C)C)C
InChI=1SC20H25NO3c1116712(2)14(811)2119(23)1813(3)1715(22)920(45)1016(17)2418h681522H910H215H3(H2123)
MFCD07493846
N(25dimethylphenyl)4hydroxy366trimethyl4567tetrahydro1benzofuran2carboxamide
N(25dimethylphenyl)4hydroxy366trimethyl4567tetrahydrobenzofuran2carboxamide
N(25dimethylphenyl)4hydroxy366trimethyl57dihydro4H1benzofuran2carboxamide
ZINC000008990899
ZINC000013680697

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.