Vitas-M small molecule compound
(1S,2S,3aR)-1-[(4-fluorophenyl)carbonyl]-2-(4-methoxyphenyl)-1,2-dihydropyrrolo[1,2-a]quinoline-3,3(3aH)-dicarbonitrile
Catalog ID
STK525160
SMILES COc1ccc(cc1)[C@@H]1[C@@H](C(=O)c2ccc(cc2)F)N2[C@@H](C1(C#N)C#N)C=Cc1c2cccc1
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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 C28H20FN3O2 MW 449.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H20FN3O2/c1-34-22-13-8-19(9-14-22)25-26(27(33)20-6-11-21(29)12-7-20)32-23-5-3-2-4-18(23)10-15-24(32)28(25,16-30)17-31/h2-15,24-26H,1H3/t24-,25-,26+/m1/s1InChIKey
YIGFLYRWYSANKM-CYXNTTPDSA-NSynonyms
303013-50-5(1S2S3aR)1((4fluorophenyl)carbonyl)2(4methoxyphenyl)12dihydropyrrolo(12a)quinoline33(3aH)dicarbonitrile
(1S2S3aR)1(4fluorobenzoyl)2(4methoxyphenyl)12dihydropyrrolo(12a)quinoline33(3aH)dicarbonitrile
(1S2S3aR)1(4fluorobenzoyl)2(4methoxyphenyl)23adihydro1Hpyrrolo(12a)quinoline33dicarbonitrile
303013505
COC1=CC=C(C=C1)C2C(N3C(C2(C#N)C#N)C=CC4=CC=CC=C43)C(=O)C5=CC=C(C=C5)F
COc1ccc(cc1)(C@@H)1(C@@H)(C(=O)c2ccc(cc2)F)N2(C@@H)(C1(C#N)C#N)C=Cc1c2cccc1
InChI=1SC28H20FN3O2c1342213819(91422)2526(27(33)2061121(29)12720)3223532418(23)101524(32)28(251630)1731h2152426H1H3t242526+m1s1
ZINC000008934240
ZINC08934240
ZINC8934240
Check stock
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