Vitas-M small molecule compound
methyl (8S,8aR,11aS,11bS)-10-(3-chloro-4-fluorophenyl)-9,11-dioxo-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-8-carboxylate
Catalog ID
STK556264
SMILES COC(=O)[C@@H]1[C@@H]2C(=O)N(C(=O)[C@@H]2[C@@H]2N1C=Cc1c2cccc1)c1ccc(c(c1)Cl)F
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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 C22H16ClFN2O4 MW 426.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16ClFN2O4/c1-30-22(29)19-17-16(18-13-5-3-2-4-11(13)8-9-25(18)19)20(27)26(21(17)28)12-6-7-15(24)14(23)10-12/h2-10,16-19H,1H3/t16-,17+,18+,19-/m0/s1InChIKey
ARWIJCWBCHOPBG-MANSERQUSA-NSynonyms
1013804-05-1(8S8aR11aS11bS)methyl10(3chloro4fluorophenyl)911dioxo8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline8carboxylate
1013804051
COC(=O)(C@@H)1(C@@H)2C(=O)N(C(=O)(C@@H)2(C@@H)2N1C=Cc1c2cccc1)c1ccc(c(c1)Cl)F
COC(=O)C1C2C(C3N1C=CC4=CC=CC=C34)C(=O)N(C2=O)C5=CC(=C(C=C5)F)Cl
InChI=1SC22H16ClFN2O4c13022(29)191716(1813532411(13)8925(18)19)20(27)26(21(17)28)126715(24)14(23)1012h2101619H1H3t1617+18+19m0s1
methyl(8S8aR11aS11bS)10(3chloro4fluorophenyl)911dioxo8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline8carboxylate
MFCD18242930
ZINC000015974964
ZINC15974964
Check stock
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