Vitas-M small molecule compound
(1'S,2'S,3R,3a'R)-1'-(2,2-dimethylpropanoyl)-2'-(thiophen-2-ylcarbonyl)-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Catalog ID
STK551518
SMILES O=C([C@@H]1[C@H](N2[C@@H]([C@]31C(=O)Nc1c3cccc1)C=Cc1c2cccc1)C(=O)C(C)(C)C)c1cccs1
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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 C29H26N2O3S MW 482.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26N2O3S/c1-28(2,3)26(33)24-23(25(32)21-13-8-16-35-21)29(18-10-5-6-11-19(18)30-27(29)34)22-15-14-17-9-4-7-12-20(17)31(22)24/h4-16,22-24H,1-3H3,(H,30,34)/t22-,23+,24+,29-/m1/s1InChIKey
MJIMMXRDPQQIMF-CAFXQFFASA-NSynonyms
1212480-24-4(1S2S3R3aR)1(22dimethylpropanoyl)2(thiophen2ylcarbonyl)12dihydro3aHspiro(indole33pyrrolo(12a)quinolin)2(1H)one
(1S2S3R3aR)1(22dimethylpropanoyl)2(thiophene2carbonyl)spiro(1Hindole3323adihydro1Hpyrrolo(12a)quinoline)2one
(1S2S3R3aR)1pivaloyl2(thiophene2carbonyl)23adihydro1Hspiro(indoline33pyrrolo(12a)quinolin)2one
1212480244
CC(C)(C)C(=O)C1C(C2(C3N1C4=CC=CC=C4C=C3)C5=CC=CC=C5NC2=O)C(=O)C6=CC=CS6
InChI=1SC29H26N2O3Sc128(23)26(33)2423(25(32)21138163521)29(1810561119(18)3027(29)34)221514179471220(17)31(22)24h4162224H13H3(H3034)t2223+24+29m1s1
MFCD18242593
O=C((C@@H)1(C@H)(N2(C@@H)((C@)31C(=O)Nc1c3cccc1)C=Cc1c2cccc1)C(=O)C(C)(C)C)c1cccs1
ZINC000008744463
ZINC08744463
ZINC8744463
Check stock
See real-time availability and sample size for STK551518 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.