Vitas-M small molecule compound

(3a'S,6a'R)-3'-(1H-indol-3-ylmethyl)-5'-(2-methoxyethyl)-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
STL533558
SMILES COCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)C(=O)Nc2c1cccc2

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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 C25H24N4O4 MW 444.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4O4/c1-33-11-10-29-22(30)20-19(12-14-13-26-17-8-4-2-6-15(14)17)28-25(21(20)23(29)31)16-7-3-5-9-18(16)27-24(25)32/h2-9,13,19-21,26,28H,10-12H2,1H3,(H,27,32)/t19?,20-,21+,25?/m1/s1
InChIKey
WDTCIIAPTUSGIT-CCQQUTMYSA-N
Synonyms
956943-41-2
(3~(a)~(R)6~(a)~(S))1(1~(H)indol3ylmethyl)5(2methoxyethyl)spiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)246trione
(3aS6aR)3((1Hindol3yl)methyl)5(2methoxyethyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)3(1Hindol3ylmethyl)5(2methoxyethyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
16405420
956943412
COCCN1C(=O)(C@H)2(C@@H)(C1=O)C1(NC2Cc2c(nH)c3c2cccc3)C(=O)Nc2c1cccc2
InChI=1SC25H24N4O4c13311102922(30)2019(1214132617842615(14)17)2825(21(20)23(29)31)16735918(16)2724(25)32h291319212628H1012H21H3(H2732)t19?2021+25?m1s1
MFCD06770579
ZINC000008791729
ZINC000100779333

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Available files

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