Vitas-M small molecule compound

2'-(3,4-dimethylphenyl)-5-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
STK725054
SMILES CCc1ccc2c(c1)C1(C(=O)N2)N2CCCC2C2C1C(=O)N(C2=O)c1ccc(c(c1)C)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 C26H27N3O3 MW 429.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O3/c1-4-16-8-10-19-18(13-16)26(25(32)27-19)22-21(20-6-5-11-28(20)26)23(30)29(24(22)31)17-9-7-14(2)15(3)12-17/h7-10,12-13,20-22H,4-6,11H2,1-3H3,(H,27,32)
InChIKey
VBOJFGGJQAXEHP-UHFFFAOYSA-N
Synonyms

(3S3aR8aS8bS)2(34dimethylphenyl)5ethyl6788atetrahydro1Hspiro(indoline34pyrrolo(34a)pyrrolizine)123(2H3aH8bH)trione
2(34dimethylphenyl)5ethyl3a6788a8bhexahydro1Hspiro(indole34pyrrolo(34a)pyrrolizine)123(1H2H)trione
2(34dimethylphenyl)5ethylspiro(1Hindole343a6788a8bhexahydropyrrolo(34a)pyrrolizine)123trione
CCC1=CC2=C(C=C1)NC(=O)C23C4C(C5N3CCC5)C(=O)N(C4=O)C6=CC(=C(C=C6)C)C
CCc1ccc2c(c1)(C@@)1(C(=O)N2)N2CCC(C@H)2(C@@H)2(C@H)1C(=O)N(C2=O)c1ccc(c(c1)C)C
InChI=1SC26H27N3O3c14168101918(1316)26(25(32)2719)2221(20651128(20)26)23(30)29(24(22)31)179714(2)15(3)1217h71012132022H4611H213H3(H2732)
MFCD09698257
ZINC000016010071
ZINC000245242284

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Available files

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