Vitas-M small molecule compound
(1S,2R,3aR)-2-(2-fluorophenyl)-1-(phenylcarbonyl)-1,2-dihydropyrrolo[1,2-a]quinoline-3,3(3aH)-dicarbonitrile
Catalog ID
STK751138
SMILES N#CC1(C#N)[C@H]2C=Cc3c(N2[C@@H]([C@H]1c1ccccc1F)C(=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 C27H18FN3O MW 419.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18FN3O/c28-21-12-6-5-11-20(21)24-25(26(32)19-9-2-1-3-10-19)31-22-13-7-4-8-18(22)14-15-23(31)27(24,16-29)17-30/h1-15,23-25H/t23-,24-,25+/m1/s1InChIKey
UIPBDPSZHHSJPB-SDHSZQHLSA-NSynonyms
303012-47-7(1S2R3aR)1benzoyl2(2fluorophenyl)12dihydropyrrolo(12a)quinoline33(3aH)dicarbonitrile
(1S2R3AR)1BENZOYL2(2FLUOROPHENYL)23ADIHYDRO1HPYRROLO(12A)QUINOLINE33DICARBONITRILE
(1S2R3AR)2(2FLUOROPHENYL)1(PHENYLCARBONYL)103ADIHYDROPYRROLIDINO(12A)QUINOLINE33DICARBONITRILE
(1S2R3AR)2(2FLUOROPHENYL)1(PHENYLCARBONYL)12DIHYDROPYRROLO(12A)QUINOLINE33(3AH)DICARBONITRILE
303012477
C1=CC=C(C=C1)C(=O)C2C(C(C3N2C4=CC=CC=C4C=C3)(C#N)C#N)C5=CC=CC=C5F
InChI=1SC27H18FN3Oc282112651120(21)2425(26(32)1992131019)31221374818(22)141523(31)27(241629)1730h1152325Ht232425+m1s1
N#CC1(C#N)(C@H)2C=Cc3c(N2(C@@H)((C@H)1c1ccccc1F)C(=O)c1ccccc1)cccc3
ZINC000008780938
ZINC08780938
ZINC8780938
Check stock
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Check stock on Vitas-MAvailable files
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