Vitas-M small molecule compound

5'-(1,3-benzodioxol-5-ylmethyl)-3'-[2-(methylsulfanyl)ethyl]-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione

Catalog ID
STL528834
SMILES CSCCC1NC2(C3C1C(=O)N(C3=O)Cc1ccc3c(c1)OCO3)C(=O)Nc1c2cccc1

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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 C24H23N3O5S MW 465.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N3O5S/c1-33-9-8-16-19-20(24(26-16)14-4-2-3-5-15(14)25-23(24)30)22(29)27(21(19)28)11-13-6-7-17-18(10-13)32-12-31-17/h2-7,10,16,19-20,26H,8-9,11-12H2,1H3,(H,25,30)
InChIKey
YXKLVBVANMTDHK-UHFFFAOYSA-N
Synonyms

(1R3S3aS6aR)5(benzo(d)(13)dioxol5ylmethyl)3(2(methylthio)ethyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
4836257
5(13benzodioxol5ylmethyl)1(2methylsulfanylethyl)spiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)246trione
5(13BENZODIOXOL5YLMETHYL)1(2METHYLSULFANYLETHYL)SPIRO(123A6ATETRAHYDROPYRROLO(34C)PYRROLE331HINDOLE)246TRIONE
5(13benzodioxol5ylmethyl)3(2(methylsulfanyl)ethyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
CSCC(C@@H)1N(C@@)2((C@H)3(C@@H)1C(=O)N(C3=O)Cc1ccc3c(c1)OCO3)C(=O)Nc1c2cccc1
InChI=1SC24H23N3O5Sc13398161920(24(2616)14423515(14)2523(24)30)22(29)27(21(19)28)1113671718(1013)32123117h271016192026H891112H21H3(H2530)
MFCD31753905
ZINC000015958493
ZINC000504224570

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Available files

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