Vitas-M small molecule compound

1'-acetyl-7'-fluoro-2'-{[4-(2-methylpropyl)phenyl]carbonyl}-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one

Catalog ID
STL349375
SMILES CC(Cc1ccc(cc1)C(=O)C1C(C(=O)C)N2C(C31C(=O)Nc1c3cccc1)C=Cc1c2ccc(c1)F)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 C32H29FN2O3 MW 508.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H29FN2O3/c1-18(2)16-20-8-10-21(11-9-20)30(37)28-29(19(3)36)35-26-14-13-23(33)17-22(26)12-15-27(35)32(28)24-6-4-5-7-25(24)34-31(32)38/h4-15,17-18,27-29H,16H2,1-3H3,(H,34,38)
InChIKey
GLZOPFJFOAVXLU-UHFFFAOYSA-N
Synonyms

(1S2S3R3aR)1acetyl7fluoro2(4isobutylbenzoyl)23adihydro1Hspiro(indoline33pyrrolo(12a)quinolin)2one
1acetyl7fluoro2((4(2methylpropyl)phenyl)carbonyl)12dihydro3aHspiro(indole33pyrrolo(12a)quinolin)2(1H)one
1acetyl7fluoro2(4(2methylpropyl)benzoyl)spiro(1Hindole3323adihydro1Hpyrrolo(12a)quinoline)2one
CC(C)CC1=CC=C(C=C1)C(=O)C2C(N3C(C24C5=CC=CC=C5NC4=O)C=CC6=C3C=CC(=C6)F)C(=O)C
CC(Cc1ccc(cc1)C(=O)(C@@H)1(C@@H)(C(=O)C)N2(C@@H)((C@)31C(=O)Nc1c3cccc1)C=Cc1c2ccc(c1)F)C
InChI=1SC32H29FN2O3c118(2)162081021(11920)30(37)2829(19(3)36)3526141323(33)1722(26)121527(35)32(28)24645725(24)3431(32)38h41517182729H16H213H3(H3438)
MFCD28032636
ZINC000016007570
ZINC000245309969

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Available files

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