Vitas-M small molecule compound
(3a'S,6a'R)-5'-(1,3-benzodioxol-5-ylmethyl)-5-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
STL529658
SMILES Clc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)Cc1ccc3c(c1)OCO3)Cc1c[nH]c3c1cccc3)C(=O)N2
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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 C30H23ClN4O5 MW 554.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H23ClN4O5/c31-17-6-7-21-19(11-17)30(29(38)33-21)26-25(22(34-30)10-16-12-32-20-4-2-1-3-18(16)20)27(36)35(28(26)37)13-15-5-8-23-24(9-15)40-14-39-23/h1-9,11-12,22,25-26,32,34H,10,13-14H2,(H,33,38)/t22?,25-,26+,30?/m1/s1InChIKey
IWQPULVMROQYLD-XRFLLGRSSA-NSynonyms
956918-43-7(3~(a)~(R)6~(a)~(S))5(13benzodioxol5ylmethyl)5chloro1(1~(H)indol3ylmethyl)spiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)246trione
(3aS6aR)3((1Hindol3yl)methyl)5(benzo(d)(13)dioxol5ylmethyl)5chloro33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)5(13benzodioxol5ylmethyl)5chloro3(1Hindol3ylmethyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
16405893
956918437
Clc1ccc2c(c1)C1(NC((C@@H)3(C@H)1C(=O)N(C3=O)Cc1ccc3c(c1)OCO3)Cc1c(nH)c3c1cccc3)C(=O)N2
InChI=1SC30H23ClN4O5c3117672119(1117)30(29(38)3321)2625(22(3430)1016123220421318(16)20)27(36)35(28(26)37)1315582324(915)40143923h1911122225263234H101314H2(H3338)t22?2526+30?m1s1
MFCD07637289
ZINC000070706170
ZINC000070706178
Check stock
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Check stock on Vitas-MAvailable files
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