Vitas-M small molecule compound
(1S,2S,3aR)-1-(2,2-dimethylpropanoyl)-2-(thiophen-2-yl)-1,2-dihydropyrrolo[1,2-a]quinoline-3,3(3aH)-dicarbonitrile
Catalog ID
STK754085
SMILES N#CC1(C#N)[C@H]2C=Cc3c(N2[C@@H]([C@H]1c1cccs1)C(=O)C(C)(C)C)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 C23H21N3OS MW 387.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3OS/c1-22(2,3)21(27)20-19(17-9-6-12-28-17)23(13-24,14-25)18-11-10-15-7-4-5-8-16(15)26(18)20/h4-12,18-20H,1-3H3/t18-,19-,20+/m1/s1InChIKey
OERFJXTZGQYROY-AQNXPRMDSA-NSynonyms
293728-57-1(1S2S3aR)1(22dimethylpropanoyl)2(thiophen2yl)12dihydropyrrolo(12a)quinoline33(3aH)dicarbonitrile
(1S2S3AR)1(22DIMETHYLPROPANOYL)2THIOPHEN2YL23ADIHYDRO1HPYRROLO(12A)QUINOLINE33DICARBONITRILE
(1S2S3aR)1pivaloyl2(thiophen2yl)12dihydropyrrolo(12a)quinoline33(3aH)dicarbonitrile
293728571
CC(C)(C)C(=O)C1C(C(C2N1C3=CC=CC=C3C=C2)(C#N)C#N)C4=CC=CS4
InChI=1SC23H21N3OSc122(23)21(27)2019(1796122817)23(13241425)18111015745816(15)26(18)20h4121820H13H3t181920+m1s1
MFCD13372049
N#CC1(C#N)(C@H)2C=Cc3c(N2(C@@H)((C@H)1c1cccs1)C(=O)C(C)(C)C)cccc3
ZINC000004180943
ZINC04180943
ZINC4180943
Check stock
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Check stock on Vitas-MAvailable files
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