Vitas-M small molecule compound
2-[(1Z,3R)-1-(7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-5(6H)-ylidene)-5-methyl-2-oxohexan-3-yl]-1H-isoindole-1,3(2H)-dione
Catalog ID
STK611418
SMILES CC(C[C@@H](N1C(=O)c2c(C1=O)cccc2)C(=O)/C=C/1\NCCc2c1cc1OCOc1c2)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 C25H24N2O5 MW 432.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N2O5/c1-14(2)9-20(27-24(29)16-5-3-4-6-17(16)25(27)30)21(28)12-19-18-11-23-22(31-13-32-23)10-15(18)7-8-26-19/h3-6,10-12,14,20,26H,7-9,13H2,1-2H3/b19-12-/t20-/m1/s1InChIKey
JLNCWOYFUJHMEJ-NURJGKTBSA-NSynonyms
(SZ)2(1(78dihydro(13)dioxolo(45g)isoquinolin5(6H)ylidene)5methyl2oxohexan3yl)isoindoline13dione
2((1Z3R)1(78dihydro(13)dioxolo(45g)isoquinolin5(6H)ylidene)5methyl2oxohexan3yl)1Hisoindole13(2H)dione
2((1Z3R)1(78dihydro6H(13)dioxolo(45g)isoquinolin5ylidene)5methyl2oxohexan3yl)isoindole13dione
CC(C(C@@H)(N1C(=O)c2c(C1=O)cccc2)C(=O)C=C1NCCc2c1cc1OCOc1c2)C
CC(C(C@H)(N1C(=O)c2c(C1=O)cccc2)C(=O)C=C1NCCc2c1cc1OCOc1c2)C
CC(C)CC(C(=O)C=C1C2=CC3=C(C=C2CCN1)OCO3)N4C(=O)C5=CC=CC=C5C4=O
InChI=1SC25H24N2O5c114(2)920(2724(29)16534617(16)25(27)30)21(28)121918112322(31133223)1015(18)782619h361012142026H7913H212H3b1912t20m1s1
MFCD08284752
ZINC000009130428
ZINC09130428
ZINC9130428
Check stock
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Check stock on Vitas-MAvailable files
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