Vitas-M small molecule compound

2'-[(2,5-dimethoxyphenyl)carbonyl]-1'-[(2-fluorophenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one

Catalog ID
STL052779
SMILES COc1ccc(c(c1)C(=O)C1C(C(=O)c2ccccc2F)N2C(C31C(=O)Nc1c3cccc1)C=Cc1c2cccc1)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 C35H27FN2O5 MW 574.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H27FN2O5/c1-42-21-16-17-28(43-2)23(19-21)32(39)30-31(33(40)22-10-4-6-12-25(22)36)38-27-14-8-3-9-20(27)15-18-29(38)35(30)24-11-5-7-13-26(24)37-34(35)41/h3-19,29-31H,1-2H3,(H,37,41)
InChIKey
XDHCAZPPMAKEJD-UHFFFAOYSA-N
Synonyms

(1S2S3R3aR)2(25dimethoxybenzoyl)1(2fluorobenzoyl)23adihydro1Hspiro(indoline33pyrrolo(12a)quinolin)2one
2((25dimethoxyphenyl)carbonyl)1((2fluorophenyl)carbonyl)12dihydro3aHspiro(indole33pyrrolo(12a)quinolin)2(1H)one
2(25dimethoxybenzoyl)1(2fluorobenzoyl)spiro(1Hindole3323adihydro1Hpyrrolo(12a)quinoline)2one
COC1=CC(=C(C=C1)OC)C(=O)C2C(N3C(C24C5=CC=CC=C5NC4=O)C=CC6=CC=CC=C63)C(=O)C7=CC=CC=C7F
COc1ccc(c(c1)C(=O)(C@@H)1(C@@H)(C(=O)c2ccccc2F)N2(C@@H)((C@)31C(=O)Nc1c3cccc1)C=Cc1c2cccc1)OC
InChI=1SC35H27FN2O5c14221161728(432)23(1921)32(39)3031(33(40)2210461225(22)36)38271483920(27)151829(38)35(30)2411571326(24)3734(35)41h3192931H12H3(H3741)
MFCD05735957
ZINC000102890763
ZINC000245247595

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Available files

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