Vitas-M small molecule compound
2-amino-4-{3-[(4-chlorophenoxy)methyl]-2,4,6-trimethylphenyl}-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STK955830
SMILES N#CC1=C(N)OC2=C(C1c1c(C)cc(c(c1C)COc1ccc(cc1)Cl)C)C(=O)CCC2
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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 C26H25ClN2O3 MW 448.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25ClN2O3/c1-14-11-15(2)23(16(3)20(14)13-31-18-9-7-17(27)8-10-18)24-19(12-28)26(29)32-22-6-4-5-21(30)25(22)24/h7-11,24H,4-6,13,29H2,1-3H3InChIKey
ZTKDETAUYPTBFI-UHFFFAOYSA-NSynonyms
445024-59-92amino4(3((4chlorophenoxy)methyl)246trimethylphenyl)5oxo4678tetrahydrochromene3carbonitrile
2amino4(3((4chlorophenoxy)methyl)246trimethylphenyl)5oxo5678tetrahydro4Hchromene3carbonitrile
445024599
CC1=CC(=C(C(=C1C2C(=C(OC3=C2C(=O)CCC3)N)C#N)C)COC4=CC=C(C=C4)Cl)C
InChI=1SC26H25ClN2O3c1141115(2)23(16(3)20(14)1331189717(27)81018)2419(1228)26(29)322264521(30)25(22)24h71124H461329H213H3
MFCD02605300
ZINC000001002719
ZINC000001002720
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