Vitas-M small molecule compound
(6aR,6bS,9aR,10S)-8-(3-chloro-4-fluorophenyl)-10-(phenylcarbonyl)-9a,10-dihydro-6aH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]quinoline-7,9(6bH,8H)-dione
Catalog ID
STK573657
SMILES O=C1N(c2ccc(c(c2)Cl)F)C(=O)[C@@H]2[C@H]1[C@H]1C=Cc3c(N1[C@@H]2C(=O)c1ccccc1)cccc3
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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 C27H18ClFN2O3 MW 472.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18ClFN2O3/c28-18-14-17(11-12-19(18)29)30-26(33)22-21-13-10-15-6-4-5-9-20(15)31(21)24(23(22)27(30)34)25(32)16-7-2-1-3-8-16/h1-14,21-24H/t21-,22-,23-,24+/m1/s1InChIKey
JQCGJKRJABMUAI-YCAMKHIRSA-NSynonyms
1013871-39-0(6aR6bS9aR10S)10benzoyl8(3chloro4fluorophenyl)9a10dihydro6aHpyrrolo(3434)pyrrolo(12a)quinoline79(6bH8H)dione
(6aR6bS9aR10S)8(3chloro4fluorophenyl)10(phenylcarbonyl)9a10dihydro6aHpyrrolo(3434)pyrrolo(12a)quinoline79(6bH8H)dione
1013871390
C1=CC=C(C=C1)C(=O)C2C3C(C4N2C5=CC=CC=C5C=C4)C(=O)N(C3=O)C6=CC(=C(C=C6)F)Cl
InChI=1SC27H18ClFN2O3c28181417(111219(18)29)3026(33)2221131015645920(15)31(21)24(23(22)27(30)34)25(32)167213816h1142124Ht21222324+m1s1
MFCD18245484
O=C1N(c2ccc(c(c2)Cl)F)C(=O)(C@@H)2(C@H)1(C@H)1C=Cc3c(N1(C@@H)2C(=O)c1ccccc1)cccc3
ZINC000009243019
ZINC09243019
ZINC9243019
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.