Vitas-M small molecule compound
6-chloro-3-{2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-4-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-2H-chromen-2-one
Catalog ID
STK605704
SMILES COc1ccccc1N1CCN(CC1)C(=O)Cc1c(=O)oc2c(c1C)cc(c(c2)OCC(=C)C)Cl
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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 C27H29ClN2O5 MW 496.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29ClN2O5/c1-17(2)16-34-25-15-24-19(13-21(25)28)18(3)20(27(32)35-24)14-26(31)30-11-9-29(10-12-30)22-7-5-6-8-23(22)33-4/h5-8,13,15H,1,9-12,14,16H2,2-4H3InChIKey
MYRNHCHMAOABTK-UHFFFAOYSA-NSynonyms
920475-54-36chloro3(2(4(2methoxyphenyl)piperazin1yl)2oxoethyl)4methyl7((2methylallyl)oxy)2Hchromen2one
6chloro3(2(4(2methoxyphenyl)piperazin1yl)2oxoethyl)4methyl7((2methylprop2en1yl)oxy)2Hchromen2one
6chloro3(2(4(2methoxyphenyl)piperazin1yl)2oxoethyl)4methyl7(2methylprop2enoxy)chromen2one
920475543
CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OCC(=C)C)CC(=O)N3CCN(CC3)C4=CC=CC=C4OC
InChI=1SC27H29ClN2O5c117(2)163425152419(1321(25)28)18(3)20(27(32)3524)1426(31)3011929(101230)22756823(22)334h581315H19121416H224H3
MFCD08743467
ZINC000009060653
ZINC09060653
ZINC9060653
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