Vitas-M small molecule compound

prop-2-en-1-yl 4-(3,5-di-tert-butyl-4-hydroxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STK811371
SMILES C=CCOC(=O)C1=C(C)NC(=O)NC1c1cc(c(c(c1)C(C)(C)C)O)C(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 C23H32N2O4 MW 400.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H32N2O4/c1-9-10-29-20(27)17-13(2)24-21(28)25-18(17)14-11-15(22(3,4)5)19(26)16(12-14)23(6,7)8/h9,11-12,18,26H,1,10H2,2-8H3,(H2,24,25,28)
InChIKey
AHAPDGBSVPBDSR-UHFFFAOYSA-N
Synonyms

CC1=C(C(NC(=O)N1)C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)C(=O)OCC=C
InChI=1SC23H32N2O4c19102920(27)1713(2)2421(28)2518(17)141115(22(34)5)19(26)16(1214)23(67)8h911121826H110H228H3(H2242528)
MFCD03696084
prop2en1yl4(35ditertbutyl4hydroxyphenyl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
PROP2ENYL4(35DITERTBUTYL4HYDROXYPHENYL)6METHYL2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
ZINC000004145251
ZINC000004145253

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Available files

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