Vitas-M small molecule compound
4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-2-(1H-pyrrol-1-yl)-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STK783701
SMILES COc1ccc(cc1)C1C(=C(OC2=C1C(=O)CC(C2)(C)C)n1cccc1)C#N
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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 C23H22N2O3 MW 374.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N2O3/c1-23(2)12-18(26)21-19(13-23)28-22(25-10-4-5-11-25)17(14-24)20(21)15-6-8-16(27-3)9-7-15/h4-11,20H,12-13H2,1-3H3InChIKey
UXFGEPJVFNEQBQ-UHFFFAOYSA-NSynonyms
4(4methoxyphenyl)77dimethyl5oxo2(1Hpyrrol1yl)5678tetrahydro4Hchromene3carbonitrile
4(4METHOXYPHENYL)77DIMETHYL5OXO2PYRROL1YL68DIHYDRO4HCHROMENE3CARBONITRILE
CC1(CC2=C(C(C(=C(O2)N3C=CC=C3)C#N)C4=CC=C(C=C4)OC)C(=O)C1)C
InChI=1SC23H22N2O3c123(2)1218(26)2119(1323)2822(2510451125)17(1424)20(21)156816(273)9715h41120H1213H213H3
MFCD06618855
ZINC000004751891
ZINC000004751892
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