Vitas-M small molecule compound
8-(1,3-benzodioxol-5-ylcarbonyl)-10-[3-(trifluoromethyl)phenyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Catalog ID
STL160655
SMILES O=C(C1N2C=Cc3c(C2C2C1C(=O)N(C2=O)c1cccc(c1)C(F)(F)F)cccc3)c1ccc2c(c1)OCO2
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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 C29H19F3N2O5 MW 532.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H19F3N2O5/c30-29(31,32)17-5-3-6-18(13-17)34-27(36)22-23(28(34)37)25(26(35)16-8-9-20-21(12-16)39-14-38-20)33-11-10-15-4-1-2-7-19(15)24(22)33/h1-13,22-25H,14H2InChIKey
MAPXRJMSCMUKTM-UHFFFAOYSA-NSynonyms
(8S8aR11aS)8(benzo(d)(13)dioxole5carbonyl)10(3(trifluoromethyl)phenyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
8(13benzodioxol5ylcarbonyl)10(3(trifluoromethyl)phenyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
C1OC2=C(O1)C=C(C=C2)C(=O)C3C4C(C5N3C=CC6=CC=CC=C56)C(=O)N(C4=O)C7=CC=CC(=C7)C(F)(F)F
InChI=1SC29H19F3N2O5c3029(3132)1753618(1317)3427(36)2223(28(34)37)25(26(35)16892021(1216)39143820)33111015412719(15)24(22)33h1132225H14H2
MFCD20759102
O=C((C@H)1N2C=Cc3c(C2(C@@H)2(C@H)1C(=O)N(C2=O)c1cccc(c1)C(F)(F)F)cccc3)c1ccc2c(c1)OCO2
ZINC000101156344
ZINC000245246452
Check stock
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Check stock on Vitas-MAvailable files
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