Vitas-M small molecule compound
(1R,2R,3S)-2-phenyl-3-(phenylcarbonyl)-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-1,3-dicarbonitrile
Catalog ID
STK367418
SMILES N#C[C@@H]1N2c3ccccc3C=CC2[C@@]([C@H]1c1ccccc1)(C#N)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 C27H19N3O MW 401.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19N3O/c28-17-23-25(20-10-3-1-4-11-20)27(18-29,26(31)21-12-5-2-6-13-21)24-16-15-19-9-7-8-14-22(19)30(23)24/h1-16,23-25H/t23-,24?,25-,27+/m0/s1InChIKey
RGCFIAXIUKVGCX-SEURSRMOSA-NSynonyms
(1R2R3S)2phenyl3(phenylcarbonyl)1233atetrahydropyrrolo(12a)quinoline13dicarbonitrile
(1R2R3S)3benzoyl2phenyl23adihydro1Hpyrrolo(12a)quinoline13dicarbonitrile
C1=CC=C(C=C1)C2C(N3C(C2(C#N)C(=O)C4=CC=CC=C4)C=CC5=CC=CC=C53)C#N
InChI=1SC27H19N3Oc28172325(20103141120)27(182926(31)21125261321)241615199781422(19)30(23)24h1162325Ht2324?2527+m0s1
MFCD13368841
N#C(C@@H)1N2c3ccccc3C=CC2(C@@)((C@H)1c1ccccc1)(C#N)C(=O)c1ccccc1
ZINC000004016112
ZINC000004016113
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