Vitas-M small molecule compound

7'-chloro-1'-(2,2-dimethylpropanoyl)-2'-(3,4,5-trimethoxyphenyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione

Catalog ID
STK569812
SMILES COc1c(OC)cc(cc1OC)C1C(N2C(C31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)Cl)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 C34H32ClNO6 MW 586.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H32ClNO6/c1-33(2,3)32(39)28-27(19-16-24(40-4)29(42-6)25(17-19)41-5)34(30(37)21-9-7-8-10-22(21)31(34)38)26-14-11-18-15-20(35)12-13-23(18)36(26)28/h7-17,26-28H,1-6H3
InChIKey
YGBJCZKRUJLZRA-UHFFFAOYSA-N
Synonyms

(1R2R)7chloro1pivaloyl2(345trimethoxyphenyl)23adihydro1Hspiro(indene23pyrrolo(12a)quinoline)13dione
7chloro1(22dimethylpropanoyl)2(345trimethoxyphenyl)12dihydro3aHspiro(indene23pyrrolo(12a)quinoline)13dione
7CHLORO1(22DIMETHYLPROPANOYL)2(345TRIMETHOXYPHENYL)SPIRO(23ADIHYDRO1HPYRROLO(12A)QUINOLINE32INDENE)13DIONE
CC(C)(C)C(=O)C1C(C2(C3N1C4=C(C=C3)C=C(C=C4)Cl)C(=O)C5=CC=CC=C5C2=O)C6=CC(=C(C(=C6)OC)OC)OC
COc1c(OC)cc(cc1OC)(C@H)1(C@@H)(N2C(C31C(=O)c1c(C3=O)cccc1)C=Cc1c2ccc(c1)Cl)C(=O)C(C)(C)C
InChI=1SC34H32ClNO6c133(23)32(39)2827(191624(404)29(426)25(1719)415)34(30(37)219781022(21)31(34)38)261411181520(35)121323(18)36(26)28h7172628H16H3
MFCD05734063
ZINC000102559174
ZINC000229934898

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.