Vitas-M small molecule compound
(8S,8aR,11aS,11bS)-10-(4-fluorophenyl)-8-(phenylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Catalog ID
STK535434
SMILES Fc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)[C@@H]1N([C@@H]2C(=O)c2ccccc2)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 C27H19FN2O3 MW 438.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19FN2O3/c28-18-10-12-19(13-11-18)30-26(32)21-22(27(30)33)24(25(31)17-7-2-1-3-8-17)29-15-14-16-6-4-5-9-20(16)23(21)29/h1-15,21-24H/t21-,22+,23+,24-/m0/s1InChIKey
MVPHSFJCNQYQEH-KEZOAJOQSA-NSynonyms
(8S8aR11aS11bS)10(4fluorophenyl)8(phenylcarbonyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
(8S8aR11aS11bS)8benzoyl10(4fluorophenyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
C1=CC=C(C=C1)C(=O)C2C3C(C4N2C=CC5=CC=CC=C45)C(=O)N(C3=O)C6=CC=C(C=C6)F
Fc1ccc(cc1)N1C(=O)(C@@H)2(C@H)(C1=O)(C@@H)1N((C@@H)2C(=O)c2ccccc2)C=Cc2c1cccc2
InChI=1SC27H19FN2O3c2818101219(131118)3026(32)2122(27(30)33)24(25(31)177213817)29151416645920(16)23(21)29h1152124Ht2122+23+24m0s1
MFCD18241645
ZINC000018158748
ZINC18158748
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