Vitas-M small molecule compound

(2'S,3S,3'S,10b'R)-2'-[(2,5-dimethoxyphenyl)carbonyl]-3'-(2,2-dimethylpropanoyl)-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one

Catalog ID
STK552303
SMILES COc1ccc(c(c1)C(=O)[C@@H]1[C@H](N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2)C(=O)C(C)(C)C)OC

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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 C33H32N2O5 MW 536.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H32N2O5/c1-32(2,3)30(37)27-26(28(36)22-18-20(39-4)14-15-25(22)40-5)33(23-12-8-9-13-24(23)34-31(33)38)29-21-11-7-6-10-19(21)16-17-35(27)29/h6-18,26-27,29H,1-5H3,(H,34,38)/t26-,27-,29+,33+/m0/s1
InChIKey
GEHKWNZHBVKLTB-LMFMZMNVSA-N
Synonyms
1177565-38-6
(1S2S3S10bR)2(25dimethoxybenzoyl)3pivaloyl310bdihydro2Hspiro(indoline31pyrrolo(21a)isoquinolin)2one
(2S3S3S10bR)2((25dimethoxyphenyl)carbonyl)3(22dimethylpropanoyl)23dihydro10bHspiro(indole31pyrrolo(21a)isoquinolin)2(1H)one
(2S3S3S10bR)2(25dimethoxybenzoyl)3(22dimethylpropanoyl)spiro(1Hindole31310bdihydro2Hpyrrolo(21a)isoquinoline)2one
1177565386
CC(C)(C)C(=O)C1C(C2(C3N1C=CC4=CC=CC=C34)C5=CC=CC=C5NC2=O)C(=O)C6=C(C=CC(=C6)OC)OC
COc1ccc(c(c1)C(=O)(C@@H)1(C@H)(N2(C@@H)((C@@)31C(=O)Nc1c3cccc1)c1ccccc1C=C2)C(=O)C(C)(C)C)OC
InChI=1SC33H32N2O5c132(23)30(37)2726(28(36)221820(394)141525(22)405)33(2312891324(23)3431(33)38)292111761019(21)161735(27)29h618262729H15H3(H3438)t262729+33+m0s1
MFCD18242640
ZINC000100999613
ZINC100999613

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Available files

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