Vitas-M small molecule compound
4-(4-hydroxy-3-methoxyphenyl)-7,7-dimethyl-5-oxo-2-(1H-pyrrol-1-yl)-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STK783704
SMILES N#CC1=C(OC2=C(C1c1ccc(c(c1)OC)O)C(=O)CC(C2)(C)C)n1cccc1
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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 C23H22N2O4 MW 390.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N2O4/c1-23(2)11-17(27)21-19(12-23)29-22(25-8-4-5-9-25)15(13-24)20(21)14-6-7-16(26)18(10-14)28-3/h4-10,20,26H,11-12H2,1-3H3InChIKey
OYQIWXWWJQRYOQ-UHFFFAOYSA-NSynonyms
4(4hydroxy3methoxyphenyl)77dimethyl5oxo2(1Hpyrrol1yl)5678tetrahydro4Hchromene3carbonitrile
4(4HYDROXY3METHOXYPHENYL)77DIMETHYL5OXO2PYRROL1YL68DIHYDRO4HCHROMENE3CARBONITRILE
CC1(CC2=C(C(C(=C(O2)N3C=CC=C3)C#N)C4=CC(=C(C=C4)O)OC)C(=O)C1)C
InChI=1SC23H22N2O4c123(2)1117(27)2119(1223)2922(25845925)15(1324)20(21)146716(26)18(1014)283h4102026H1112H213H3
MFCD06618858
ZINC000004751901
ZINC000004751903
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