Vitas-M small molecule compound
(2R,3S,3aS)-2-(4-chlorophenyl)-3-(phenylcarbonyl)-3,3a-dihydropyrrolo[1,2-a]quinoline-1,1(2H)-dicarbonitrile
Catalog ID
STL170402
SMILES N#CC1(C#N)[C@@H](c2ccc(cc2)Cl)[C@@H]([C@H]2N1c1ccccc1C=C2)C(=O)c1ccccc1
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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 C27H18ClN3O MW 435.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18ClN3O/c28-21-13-10-19(11-14-21)25-24(26(32)20-7-2-1-3-8-20)23-15-12-18-6-4-5-9-22(18)31(23)27(25,16-29)17-30/h1-15,23-25H/t23-,24+,25-/m0/s1InChIKey
GALYBOBKSUAVHA-GVAUOCQISA-NSynonyms
1212108-04-7(2R3S3aS)2(4chlorophenyl)3(phenylcarbonyl)33adihydropyrrolo(12a)quinoline11(2H)dicarbonitrile
(2R3S3aS)3benzoyl2(4chlorophenyl)33adihydro2Hpyrrolo(12a)quinoline11dicarbonitrile
1212108047
C1=CC=C(C=C1)C(=O)C2C3C=CC4=CC=CC=C4N3C(C2C5=CC=C(C=C5)Cl)(C#N)C#N
InChI=1SC27H18ClN3Oc2821131019(111421)2524(26(32)207213820)23151218645922(18)31(23)27(251629)1730h1152325Ht2324+25m0s1
N#CC1(C#N)(C@@H)(c2ccc(cc2)Cl)(C@@H)((C@H)2N1c1ccccc1C=C2)C(=O)c1ccccc1
ZINC000016000594
ZINC16000594
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