Vitas-M small molecule compound
2-{3-[(3aS,6aS)-5-(1,3-benzodioxol-5-yl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazol-3-yl]-3-oxopropyl}-1H-isoindole-1,3(2H)-dione
Catalog ID
STK543412
SMILES O=C1N(c2ccc3c(c2)OCO3)C(=O)[C@@H]2[C@H]1C(=NN2)C(=O)CCN1C(=O)c2c(C1=O)cccc2
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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 C23H16N4O7 MW 460.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16N4O7/c28-14(7-8-26-20(29)12-3-1-2-4-13(12)21(26)30)18-17-19(25-24-18)23(32)27(22(17)31)11-5-6-15-16(9-11)34-10-33-15/h1-6,9,17,19,25H,7-8,10H2/t17-,19+/m1/s1InChIKey
NQEQQKIHDQKEKX-MJGOQNOKSA-NSynonyms
958978-28-42(3((3aS6aS)5(13benzodioxol5yl)46dioxo13a4566ahexahydropyrrolo(34c)pyrazol3yl)3oxopropyl)1Hisoindole13(2H)dione
2(3((3aS6aS)5(13benzodioxol5yl)46dioxo3a6adihydro1Hpyrrolo(34c)pyrazol3yl)3oxopropyl)isoindole13dione
2(3((3aS6aS)5(benzo(d)(13)dioxol5yl)46dioxo13a4566ahexahydropyrrolo(34c)pyrazol3yl)3oxopropyl)isoindoline13dione
958978284
C1OC2=C(O1)C=C(C=C2)N3C(=O)C4C(C3=O)NN=C4C(=O)CCN5C(=O)C6=CC=CC=C6C5=O
InChI=1SC23H16N4O7c2814(782620(29)12312413(12)21(26)30)181719(252418)23(32)27(22(17)31)11561516(911)34103315h169171925H7810H2t1719+m1s1
MFCD18242082
O=C1N(c2ccc3c(c2)OCO3)C(=O)(C@@H)2(C@H)1C(=NN2)C(=O)CCN1C(=O)c2c(C1=O)cccc2
ZINC000018066102
ZINC18066102
Check stock
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Check stock on Vitas-MAvailable files
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