Vitas-M small molecule compound
8-(1,3-benzodioxol-5-ylcarbonyl)-10-(4-fluorophenyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Catalog ID
STL343174
SMILES Fc1ccc(cc1)N1C(=O)C2C(C1=O)C1N(C2C(=O)c2ccc3c(c2)OCO3)C=Cc2c1cccc2
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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 C28H19FN2O5 MW 482.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H19FN2O5/c29-17-6-8-18(9-7-17)31-27(33)22-23(28(31)34)25(26(32)16-5-10-20-21(13-16)36-14-35-20)30-12-11-15-3-1-2-4-19(15)24(22)30/h1-13,22-25H,14H2InChIKey
RIDLRYXCVLXCLQ-UHFFFAOYSA-NSynonyms
(8S8aR11aS)8(benzo(d)(13)dioxole5carbonyl)10(4fluorophenyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
8(13benzodioxol5ylcarbonyl)10(4fluorophenyl)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=C(C=C7)F
Fc1ccc(cc1)N1C(=O)(C@@H)2(C@H)(C1=O)C1N((C@@H)2C(=O)c2ccc3c(c2)OCO3)C=Cc2c1cccc2
InChI=1SC28H19FN2O5c29176818(9717)3127(33)2223(28(31)34)25(26(32)165102021(1316)36143520)30121115312419(15)24(22)30h1132225H14H2
MFCD07211220
ZINC000013768206
ZINC000245240418
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