Vitas-M small molecule compound
2-amino-4-{3-[(4-chlorophenoxy)methyl]-4-methoxyphenyl}-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STL173575
SMILES N#CC1=C(N)OC2=C(C1c1ccc(c(c1)COc1ccc(cc1)Cl)OC)C(=O)CC(C2)(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 C26H25ClN2O4 MW 464.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25ClN2O4/c1-26(2)11-20(30)24-22(12-26)33-25(29)19(13-28)23(24)15-4-9-21(31-3)16(10-15)14-32-18-7-5-17(27)6-8-18/h4-10,23H,11-12,14,29H2,1-3H3InChIKey
XARNDBXZMMKBLZ-UHFFFAOYSA-NSynonyms
2AMINO4(3((4CHLOROPHENOXY)METHYL)4METHOXYPHENYL)77DIMETHYL5OXO4H678TRIHYDROCHROMENE3CARBONITRILE
2amino4(3((4chlorophenoxy)methyl)4methoxyphenyl)77dimethyl5oxo5678tetrahydro4Hchromene3carbonitrile
2AMINO4(3((4CHLOROPHENOXY)METHYL)4METHOXYPHENYL)77DIMETHYL5OXO68DIHYDRO4HCHROMENE3CARBONITRILE
CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC(=C(C=C3)OC)COC4=CC=C(C=C4)Cl)C(=O)C1)C
InChI=1SC26H25ClN2O4c126(2)1120(30)2422(1226)3325(29)19(1328)23(24)154921(313)16(1015)1432187517(27)6818h41023H11121429H213H3
MFCD01466494
ZINC000000660206
ZINC000000660209
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