Vitas-M small molecule compound

(1'R,2'S,3R)-2'-[(3,4-dimethoxyphenyl)carbonyl]-2-oxo-N-phenyl-1,1',2,2'-tetrahydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinoline]-1'-carboxamide

Catalog ID
STL527376
SMILES COc1ccc(cc1OC)C(=O)[C@@H]1[C@H](C(=O)Nc2ccccc2)N2C([C@]31C(=O)Nc1c3cccc1)C=Cc1c2cccc1

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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 C35H29N3O5 MW 571.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H29N3O5/c1-42-27-18-16-22(20-28(27)43-2)32(39)30-31(33(40)36-23-11-4-3-5-12-23)38-26-15-9-6-10-21(26)17-19-29(38)35(30)24-13-7-8-14-25(24)37-34(35)41/h3-20,29-31H,1-2H3,(H,36,40)(H,37,41)/t29?,30-,31+,35+/m0/s1
InChIKey
YUDJOXKWGWQRIQ-BABAAGAESA-N
Synonyms
1214633-07-4
(1~(R)2~(S)3~(R))2(34dimethoxybenzoyl)2oxo~(N)phenylspiro(1~(H)indole3323~(a)dihydro1~(H)pyrrolo(12a)quinoline)1carboxamide
(1R2S3R)2((34dimethoxyphenyl)carbonyl)2oxoNphenyl1122tetrahydro3aHspiro(indole33pyrrolo(12a)quinoline)1carboxamide
(1R2S3R)2(34dimethoxybenzoyl)2oxoNphenyl23adihydro1Hspiro(indoline33pyrrolo(12a)quinoline)1carboxamide
1214633074
16397640
COc1ccc(cc1OC)C(=O)(C@@H)1(C@H)(C(=O)Nc2ccccc2)N2C((C@)31C(=O)Nc1c3cccc1)C=Cc1c2cccc1
InChI=1SC35H29N3O5c14227181622(2028(27)432)32(39)3031(33(40)3623114351223)382615961021(26)171929(38)35(30)2413781425(24)3734(35)41h3202931H12H3(H3640)(H3741)t29?3031+35+m0s1
MFCD03266459
ZINC000070672314
ZINC000070672317

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Available files

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