Vitas-M small molecule compound

(3S,3a'R,8a'S,8b'S)-2'-(2-bromo-4-methylphenyl)-7-ethyl-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
STK577469
SMILES CCc1cccc2c1NC(=O)[C@]12N2CCC[C@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1Br)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 C25H24BrN3O3 MW 494.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24BrN3O3/c1-3-14-6-4-7-15-21(14)27-24(32)25(15)20-19(18-8-5-11-28(18)25)22(30)29(23(20)31)17-10-9-13(2)12-16(17)26/h4,6-7,9-10,12,18-20H,3,5,8,11H2,1-2H3,(H,27,32)/t18-,19+,20-,25+/m0/s1
InChIKey
PICXHGZDBRWSQO-PBQROFAYSA-N
Synonyms
1014003-65-6
(3S3aR8aS8bS)2(2bromo4methylphenyl)7ethyl3a6788a8bhexahydro1Hspiro(indole34pyrrolo(34a)pyrrolizine)123(1H2H)trione
(3S3aR8aS8bS)2(2bromo4methylphenyl)7ethyl6788atetrahydro1Hspiro(indoline34pyrrolo(34a)pyrrolizine)123(2H3aH8bH)trione
(3S3aR8aS8bS)2(2bromo4methylphenyl)7ethylspiro(1Hindole343a6788a8bhexahydropyrrolo(34a)pyrrolizine)123trione
1014003656
CCC1=CC=CC2=C1NC(=O)C23C4C(C5N3CCC5)C(=O)N(C4=O)C6=C(C=C(C=C6)C)Br
CCc1cccc2c1NC(=O)(C@)12N2CCC(C@H)2(C@@H)2(C@H)1C(=O)N(C2=O)c1ccc(cc1Br)C
InChI=1SC25H24BrN3O3c13146471521(14)2724(32)25(15)2019(18851128(18)25)22(30)29(23(20)31)1710913(2)1216(17)26h467910121820H35811H212H3(H2732)t1819+2025+m0s1
MFCD18245582
ZINC000016012421
ZINC16012421

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Available files

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