Vitas-M small molecule compound

(1'S,2'S,3R,3a'R)-2'-[(2-chlorophenyl)carbonyl]-1'-(2,2-dimethylpropanoyl)-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one

Catalog ID
STK554940
SMILES Clc1ccccc1C(=O)[C@@H]1[C@H](N2[C@@H]([C@]31C(=O)Nc1c3cccc1)C=Cc1c2cccc1)C(=O)C(C)(C)C

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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 C31H27ClN2O3 MW 511.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27ClN2O3/c1-30(2,3)28(36)26-25(27(35)19-11-5-7-13-21(19)32)31(20-12-6-8-14-22(20)33-29(31)37)24-17-16-18-10-4-9-15-23(18)34(24)26/h4-17,24-26H,1-3H3,(H,33,37)/t24-,25+,26+,31-/m1/s1
InChIKey
HWVSCFRMVDRTPK-SQRAXXTESA-N
Synonyms
1177935-43-1
(1S2S3R3aR)2((2chlorophenyl)carbonyl)1(22dimethylpropanoyl)12dihydro3aHspiro(indole33pyrrolo(12a)quinolin)2(1H)one
(1S2S3R3aR)2(2chlorobenzoyl)1(22dimethylpropanoyl)spiro(1Hindole3323adihydro1Hpyrrolo(12a)quinoline)2one
(1S2S3R3aR)2(2chlorobenzoyl)1pivaloyl23adihydro1Hspiro(indoline33pyrrolo(12a)quinolin)2one
1177935431
CC(C)(C)C(=O)C1C(C2(C3N1C4=CC=CC=C4C=C3)C5=CC=CC=C5NC2=O)C(=O)C6=CC=CC=C6Cl
Clc1ccccc1C(=O)(C@@H)1(C@H)(N2(C@@H)((C@)31C(=O)Nc1c3cccc1)C=Cc1c2cccc1)C(=O)C(C)(C)C
InChI=1SC31H27ClN2O3c130(23)28(36)2625(27(35)1911571321(19)32)31(2012681422(20)3329(31)37)2417161810491523(18)34(24)26h4172426H13H3(H3337)t2425+26+31m1s1
MFCD18242831
ZINC000009463574
ZINC09463574
ZINC9463574

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Available files

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