Vitas-M small molecule compound
ethyl (1S,2S,3S)-3-cyano-1-(2,2-dimethylpropanoyl)-2-phenyl-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxylate
Catalog ID
STK554448
SMILES CCOC(=O)[C@@]1(C#N)[C@H](c2ccccc2)[C@H](N2C1C=Cc1c2cccc1)C(=O)C(C)(C)C
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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 C27H28N2O3 MW 428.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2O3/c1-5-32-25(31)27(17-28)21-16-15-18-11-9-10-14-20(18)29(21)23(24(30)26(2,3)4)22(27)19-12-7-6-8-13-19/h6-16,21-23H,5H2,1-4H3/t21?,22-,23+,27-/m1/s1InChIKey
ZBPYCSQAPDWGIA-FTLVJZLWSA-NSynonyms
1014103-70-8(1S2S3S)ethyl3cyano2phenyl1pivaloyl1233atetrahydropyrrolo(12a)quinoline3carboxylate
1014103708
CCOC(=O)(C@@)1(C#N)(C@H)(c2ccccc2)(C@H)(N2C1C=Cc1c2cccc1)C(=O)C(C)(C)C
CCOC(=O)C1(C2C=CC3=CC=CC=C3N2C(C1C4=CC=CC=C4)C(=O)C(C)(C)C)C#N
ethyl(1S2S3S)3cyano1(22dimethylpropanoyl)2phenyl1233atetrahydropyrrolo(12a)quinoline3carboxylate
ethyl(1S2S3S)3cyano1(22dimethylpropanoyl)2phenyl23adihydro1Hpyrrolo(12a)quinoline3carboxylate
InChI=1SC27H28N2O3c153225(31)27(1728)21161518119101420(18)29(21)23(24(30)26(23)4)22(27)19127681319h6162123H5H214H3t21?2223+27m1s1
MFCD18242801
ZINC000009462591
ZINC000009465413
Check stock
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Check stock on Vitas-MAvailable files
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