Vitas-M small molecule compound

7'-chloro-2'-[(3-methoxyphenyl)carbonyl]-1'-(phenylcarbonyl)-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one

Catalog ID
STL040507
SMILES COc1cccc(c1)C(=O)C1C(C(=O)c2ccccc2)N2C(C31C(=O)Nc1c3cccc1)C=Cc1c2ccc(c1)Cl

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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 C34H25ClN2O4 MW 561.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H25ClN2O4/c1-41-24-11-7-10-22(19-24)31(38)29-30(32(39)20-8-3-2-4-9-20)37-27-16-15-23(35)18-21(27)14-17-28(37)34(29)25-12-5-6-13-26(25)36-33(34)40/h2-19,28-30H,1H3,(H,36,40)
InChIKey
CPYRTFQYDXBFGS-UHFFFAOYSA-N
Synonyms

(1S2S3R3aR)1benzoyl7chloro2(3methoxybenzoyl)23adihydro1Hspiro(indoline33pyrrolo(12a)quinolin)2one
1benzoyl7chloro2(3methoxybenzoyl)spiro(1Hindole3323adihydro1Hpyrrolo(12a)quinoline)2one
7chloro2((3methoxyphenyl)carbonyl)1(phenylcarbonyl)12dihydro3aHspiro(indole33pyrrolo(12a)quinolin)2(1H)one
COC1=CC=CC(=C1)C(=O)C2C(N3C(C24C5=CC=CC=C5NC4=O)C=CC6=C3C=CC(=C6)Cl)C(=O)C7=CC=CC=C7
COc1cccc(c1)C(=O)(C@@H)1(C@@H)(C(=O)c2ccccc2)N2(C@@H)((C@)31C(=O)Nc1c3cccc1)C=Cc1c2ccc(c1)Cl
InChI=1SC34H25ClN2O4c141241171022(1924)31(38)2930(32(39)208324920)3727161523(35)1821(27)141728(37)34(29)2512561326(25)3633(34)40h2192830H1H3(H3640)
MFCD05730738
ZINC000102866681
ZINC000245245252

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Available files

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