Vitas-M small molecule compound

5-fluoro-2'-(4-methoxyphenyl)-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
STK783548
SMILES COc1ccc(cc1)N1C(=O)C2C(C1=O)C1(N3C2CCC3)C(=O)Nc2c1cc(F)cc2

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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 C23H20FN3O4 MW 421.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20FN3O4/c1-31-14-7-5-13(6-8-14)27-20(28)18-17-3-2-10-26(17)23(19(18)21(27)29)15-11-12(24)4-9-16(15)25-22(23)30/h4-9,11,17-19H,2-3,10H2,1H3,(H,25,30)
InChIKey
BOESPHYEONFFIN-UHFFFAOYSA-N
Synonyms

(3S3aR8aS8bS)5fluoro2(4methoxyphenyl)6788atetrahydro1Hspiro(indoline34pyrrolo(34a)pyrrolizine)123(2H3aH8bH)trione
5fluoro2(4methoxyphenyl)3a6788a8bhexahydro1Hspiro(indole34pyrrolo(34a)pyrrolizine)123(1H2H)trione
5fluoro2(4methoxyphenyl)spiro(1Hindole343a6788a8bhexahydropyrrolo(34a)pyrrolizine)123trione
COC1=CC=C(C=C1)N2C(=O)C3C4CCCN4C5(C3C2=O)C6=C(C=CC(=C6)F)NC5=O
COc1ccc(cc1)N1C(=O)(C@H)2(C@@H)(C1=O)(C@@)1(N3(C@H)2CCC3)C(=O)Nc2c1cc(F)cc2
InChI=1SC23H20FN3O4c131147513(6814)2720(28)1817321026(17)23(19(18)21(27)29)151112(24)4916(15)2522(23)30h49111719H2310H21H3(H2530)
MFCD06618394
ZINC000009235023
ZINC000245225959

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Available files

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