Vitas-M small molecule compound
ethyl (1'S,2'R,3R,3a'S)-2'-{[4-(2-methylpropyl)phenyl]carbonyl}-2-oxo-1,1',2,2'-tetrahydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinoline]-1'-carboxylate
Catalog ID
STL527221
SMILES CCOC(=O)[C@H]1N2c3ccccc3C=C[C@H]2[C@]2([C@H]1C(=O)c1ccc(cc1)CC(C)C)C(=O)Nc1c2cccc1
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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 C33H32N2O4 MW 520.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H32N2O4/c1-4-39-31(37)29-28(30(36)23-15-13-21(14-16-23)19-20(2)3)33(24-10-6-7-11-25(24)34-32(33)38)27-18-17-22-9-5-8-12-26(22)35(27)29/h5-18,20,27-29H,4,19H2,1-3H3,(H,34,38)/t27-,28+,29-,33+/m0/s1InChIKey
YREZWZUEYOLVSL-KCIBBDPESA-NSynonyms
1212480-47-1(1S2R3R3aS)ethyl2(4isobutylbenzoyl)2oxo23adihydro1Hspiro(indoline33pyrrolo(12a)quinoline)1carboxylate
1212480471
16397757
CCOC(=O)(C@H)1N2c3ccccc3C=C(C@H)2(C@)2((C@H)1C(=O)c1ccc(cc1)CC(C)C)C(=O)Nc1c2cccc1
ethyl(1~(S)2~(R)3~(R)3~(a)~(S))2(4(2methylpropyl)benzoyl)2oxospiro(1~(H)indole3323~(a)dihydro1~(H)pyrrolo(12a)quinoline)1carboxylate
ethyl(1S2R3R3aS)2((4(2methylpropyl)phenyl)carbonyl)2oxo1122tetrahydro3aHspiro(indole33pyrrolo(12a)quinoline)1carboxylate
InChI=1SC33H32N2O4c143931(37)2928(30(36)23151321(141623)1920(2)3)33(2410671125(24)3432(33)38)271817229581226(22)35(27)29h518202729H419H213H3(H3438)t2728+2933+m0s1
MFCD03267067
ZINC000016040977
ZINC16040977
Check stock
See real-time availability and sample size for STL527221 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.