Vitas-M small molecule compound
(3a'S,6a'R)-5'-butyl-7-chloro-3'-(1H-indol-3-ylmethyl)-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
STL533173
SMILES CCCCN1C(=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 C26H25ClN4O3 MW 476.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25ClN4O3/c1-2-3-11-31-23(32)20-19(12-14-13-28-18-10-5-4-7-15(14)18)30-26(21(20)24(31)33)16-8-6-9-17(27)22(16)29-25(26)34/h4-10,13,19-21,28,30H,2-3,11-12H2,1H3,(H,29,34)/t19?,20-,21+,26?/m1/s1InChIKey
XAHYQSZXMCHSLW-FTUOTLPMSA-NSynonyms
956156-63-1(3~(a)~(R)6~(a)~(S))5butyl7chloro1(1~(H)indol3ylmethyl)spiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)246trione
(3aS6aR)3((1Hindol3yl)methyl)5butyl7chloro33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)5butyl7chloro3(1Hindol3ylmethyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
16405302
956156631
CCCCN1C(=O)(C@H)2(C@@H)(C1=O)C1(NC2Cc2c(nH)c3c2cccc3)C(=O)Nc2c1cccc2Cl
InChI=1SC26H25ClN4O3c123113123(32)2019(12141328181054715(14)18)3026(21(20)24(31)33)1686917(27)22(16)2925(26)34h4101319212830H231112H21H3(H2934)t19?2021+26?m1s1
MFCD06769948
ZINC000015970193
ZINC000020757172
Check stock
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Check stock on Vitas-MAvailable files
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