Vitas-M small molecule compound
2-[4-(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-4-oxobutyl]-1H-isoindole-1,3(2H)-dione
Catalog ID
STK683306
SMILES COc1cc(CCNC2=C(C(=O)CCCN3C(=O)c4c(C3=O)cccc4)C(=O)CC(C2)(C)C)ccc1OC
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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 C30H34N2O6 MW 518.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H34N2O6/c1-30(2)17-22(31-14-13-19-11-12-25(37-3)26(16-19)38-4)27(24(34)18-30)23(33)10-7-15-32-28(35)20-8-5-6-9-21(20)29(32)36/h5-6,8-9,11-12,16,31H,7,10,13-15,17-18H2,1-4H3InChIKey
KZGMLCWTDHJZFV-UHFFFAOYSA-NSynonyms
2(4(2((2(34dimethoxyphenyl)ethyl)amino)44dimethyl6oxocyclohex1en1yl)4oxobutyl)1Hisoindole13(2H)dione
2(4(2(2(34DIMETHOXYPHENYL)ETHYLAMINO)44DIMETHYL6OXOCYCLOHEXEN1YL)4OXOBUTYL)ISOINDOLE13DIONE
CC1(CC(=C(C(=O)C1)C(=O)CCCN2C(=O)C3=CC=CC=C3C2=O)NCCC4=CC(=C(C=C4)OC)OC)C
InChI=1SC30H34N2O6c130(2)1722(31141319111225(373)26(1619)384)27(24(34)1830)23(33)107153228(35)20856921(20)29(32)36h568911121631H71013151718H214H3
MFCD05257331
ZINC000100157007
ZINC100157007
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