Vitas-M small molecule compound

(3S,3a'R,8a'S,8b'S)-5-ethyl-2'-(2-fluorophenyl)-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione

Catalog ID
STK580226
SMILES CCc1ccc2c(c1)[C@@]1(C(=O)N2)N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccccc1F

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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 C24H22FN3O3 MW 419.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22FN3O3/c1-2-13-9-10-16-14(12-13)24(23(31)26-16)20-19(18-8-5-11-27(18)24)21(29)28(22(20)30)17-7-4-3-6-15(17)25/h3-4,6-7,9-10,12,18-20H,2,5,8,11H2,1H3,(H,26,31)/t18-,19+,20-,24+/m0/s1
InChIKey
JBUWXQHKOVKHEF-CMCWBKRRSA-N
Synonyms
1013981-49-1
(3S3aR8aS8bS)5ethyl2(2fluorophenyl)3a6788a8bhexahydro1Hspiro(indole34pyrrolo(34a)pyrrolizine)123(1H2H)trione
(3S3aR8aS8bS)5ethyl2(2fluorophenyl)6788atetrahydro1Hspiro(indoline34pyrrolo(34a)pyrrolizine)123(2H3aH8bH)trione
(3S3aR8aS8bS)5ethyl2(2fluorophenyl)spiro(1Hindole343a6788a8bhexahydropyrrolo(34a)pyrrolizine)123trione
1013981491
CCC1=CC2=C(C=C1)NC(=O)C23C4C(C5N3CCC5)C(=O)N(C4=O)C6=CC=CC=C6F
CCc1ccc2c(c1)(C@@)1(C(=O)N2)N2CCC(C@H)2(C@@H)2(C@H)1C(=O)N(C2=O)c1ccccc1F
InChI=1SC24H22FN3O3c12139101614(1213)24(23(31)2616)2019(18851127(18)24)21(29)28(22(20)30)17743615(17)25h3467910121820H25811H21H3(H2631)t1819+2024+m0s1
MFCD18245645
ZINC000016010040
ZINC16010040

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Available files

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