Vitas-M small molecule compound

(3S,3a'R,8a'S,8b'S)-2'-(2-bromophenyl)-7-chloro-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
STK591291
SMILES O=C1N(c2ccccc2Br)C(=O)[C@@H]2[C@H]1[C@@H]1CCCN1[C@]12C(=O)Nc2c1cccc2Cl

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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 C22H17BrClN3O3 MW 486.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17BrClN3O3/c23-12-6-1-2-8-14(12)27-19(28)16-15-9-4-10-26(15)22(17(16)20(27)29)11-5-3-7-13(24)18(11)25-21(22)30/h1-3,5-8,15-17H,4,9-10H2,(H,25,30)/t15-,16+,17-,22+/m0/s1
InChIKey
XHDWXUHYPICKIX-DVSDUFGPSA-N
Synonyms
1013886-43-5
(3S3aR8aS8bS)2(2bromophenyl)7chloro3a6788a8bhexahydro1Hspiro(indole34pyrrolo(34a)pyrrolizine)123(1H2H)trione
(3S3aR8aS8bS)2(2bromophenyl)7chloro6788atetrahydro1Hspiro(indoline34pyrrolo(34a)pyrrolizine)123(2H3aH8bH)trione
(3S3aR8aS8bS)2(2bromophenyl)7chlorospiro(1Hindole343a6788a8bhexahydropyrrolo(34a)pyrrolizine)123trione
1013886435
C1CC2C3C(C(=O)N(C3=O)C4=CC=CC=C4Br)C5(N2C1)C6=C(C(=CC=C6)Cl)NC5=O
InChI=1SC22H17BrClN3O3c2312612814(12)2719(28)1615941026(15)22(17(16)20(27)29)1153713(24)18(11)2521(22)30h13581517H4910H2(H2530)t1516+1722+m0s1
MFCD18245910
O=C1N(c2ccccc2Br)C(=O)(C@@H)2(C@H)1(C@@H)1CCCN1(C@)12C(=O)Nc2c1cccc2Cl
ZINC000016010427
ZINC16010427

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Available files

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