Vitas-M small molecule compound
(1S,2S,3aR)-2-(4-bromophenyl)-1-[(4-fluorophenyl)carbonyl]-1,2-dihydropyrrolo[1,2-a]quinoline-3,3(3aH)-dicarbonitrile
Catalog ID
STK525661
SMILES N#CC1(C#N)[C@H](c2ccc(cc2)Br)[C@H](N2[C@@H]1C=Cc1c2cccc1)C(=O)c1ccc(cc1)F
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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 C27H17BrFN3O MW 498.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H17BrFN3O/c28-20-10-5-18(6-11-20)24-25(26(33)19-7-12-21(29)13-8-19)32-22-4-2-1-3-17(22)9-14-23(32)27(24,15-30)16-31/h1-14,23-25H/t23-,24-,25+/m1/s1InChIKey
LIYHQPOLPOBELU-SDHSZQHLSA-NSynonyms
459437-99-1(1S2S3aR)2(4bromophenyl)1((4fluorophenyl)carbonyl)12dihydropyrrolo(12a)quinoline33(3aH)dicarbonitrile
(1S2S3aR)2(4bromophenyl)1(4fluorobenzoyl)12dihydropyrrolo(12a)quinoline33(3aH)dicarbonitrile
(1S2S3aR)2(4bromophenyl)1(4fluorobenzoyl)23adihydro1Hpyrrolo(12a)quinoline33dicarbonitrile
459437991
C1=CC=C2C(=C1)C=CC3N2C(C(C3(C#N)C#N)C4=CC=C(C=C4)Br)C(=O)C5=CC=C(C=C5)F
InChI=1SC27H17BrFN3Oc282010518(61120)2425(26(33)1971221(29)13819)3222421317(22)91423(32)27(241530)1631h1142325Ht232425+m1s1
N#CC1(C#N)(C@H)(c2ccc(cc2)Br)(C@H)(N2(C@@H)1C=Cc1c2cccc1)C(=O)c1ccc(cc1)F
ZINC000008926231
ZINC08926231
ZINC8926231
Check stock
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