Vitas-M small molecule compound
(1S,2R,3aR)-2-(2-chlorophenyl)-1-[(4-fluorophenyl)carbonyl]-1,2-dihydropyrrolo[1,2-a]quinoline-3,3(3aH)-dicarbonitrile
Catalog ID
STK524338
SMILES N#CC1(C#N)[C@H]2C=Cc3c(N2[C@@H]([C@H]1c1ccccc1Cl)C(=O)c1ccc(cc1)F)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 C27H17ClFN3O MW 453.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H17ClFN3O/c28-21-7-3-2-6-20(21)24-25(26(33)18-9-12-19(29)13-10-18)32-22-8-4-1-5-17(22)11-14-23(32)27(24,15-30)16-31/h1-14,23-25H/t23-,24-,25+/m1/s1InChIKey
INWHOKIPPJVRAA-SDHSZQHLSA-NSynonyms
302901-88-8(1S2R3aR)2(2chlorophenyl)1((4fluorophenyl)carbonyl)12dihydropyrrolo(12a)quinoline33(3aH)dicarbonitrile
(1S2R3aR)2(2chlorophenyl)1(4fluorobenzoyl)12dihydropyrrolo(12a)quinoline33(3aH)dicarbonitrile
(1S2R3aR)2(2chlorophenyl)1(4fluorobenzoyl)23adihydro1Hpyrrolo(12a)quinoline33dicarbonitrile
302901888
C1=CC=C2C(=C1)C=CC3N2C(C(C3(C#N)C#N)C4=CC=CC=C4Cl)C(=O)C5=CC=C(C=C5)F
InChI=1SC27H17ClFN3Oc2821732620(21)2425(26(33)1891219(29)131018)3222841517(22)111423(32)27(241530)1631h1142325Ht232425+m1s1
N#CC1(C#N)(C@H)2C=Cc3c(N2(C@@H)((C@H)1c1ccccc1Cl)C(=O)c1ccc(cc1)F)cccc3
ZINC000008926226
ZINC08926226
ZINC8926226
Check stock
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Check stock on Vitas-MAvailable files
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