Vitas-M small molecule compound
(3a'S,6a'R)-7-chloro-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
STL531160
SMILES COCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)C(=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 C25H23ClN4O4 MW 478.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23ClN4O4/c1-34-10-9-30-22(31)19-18(11-13-12-27-17-8-3-2-5-14(13)17)29-25(20(19)23(30)32)15-6-4-7-16(26)21(15)28-24(25)33/h2-8,12,18-20,27,29H,9-11H2,1H3,(H,28,33)/t18?,19-,20+,25?/m1/s1InChIKey
ZRQRINDWSNDLFI-PXRUUTNOSA-NSynonyms
956997-53-8(3~(a)~(R)6~(a)~(S))7chloro1(1~(H)indol3ylmethyl)5(2methoxyethyl)spiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)246trione
(3aS6aR)3((1Hindol3yl)methyl)7chloro5(2methoxyethyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)7chloro3(1Hindol3ylmethyl)5(2methoxyethyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
16405368
956997538
COCCN1C(=O)(C@H)2(C@@H)(C1=O)C1(NC2Cc2c(nH)c3c2cccc3)C(=O)Nc2c1cccc2Cl
InChI=1SC25H23ClN4O4c1341093022(31)1918(1113122717832514(13)17)2925(20(19)23(30)32)1564716(26)21(15)2824(25)33h281218202729H911H21H3(H2833)t18?1920+25?m1s1
MFCD06770241
ZINC000015970357
ZINC000100778977
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.