Vitas-M small molecule compound
(3a'S,6a'R)-5-chloro-3'-(1H-indol-3-ylmethyl)-5'-(3-methoxypropyl)-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
STL531790
SMILES COCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)C(=O)Nc2c1cc(Cl)cc2
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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 C26H25ClN4O4 MW 492.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25ClN4O4/c1-35-10-4-9-31-23(32)21-20(11-14-13-28-18-6-3-2-5-16(14)18)30-26(22(21)24(31)33)17-12-15(27)7-8-19(17)29-25(26)34/h2-3,5-8,12-13,20-22,28,30H,4,9-11H2,1H3,(H,29,34)/t20?,21-,22+,26?/m1/s1InChIKey
VZWNONRVGYQGSA-YPHDTHBOSA-NSynonyms
956156-37-9(3~(a)~(R)6~(a)~(S))5chloro1(1~(H)indol3ylmethyl)5(3methoxypropyl)spiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)246trione
(3aS6aR)3((1Hindol3yl)methyl)5chloro5(3methoxypropyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)5chloro3(1Hindol3ylmethyl)5(3methoxypropyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
16405373
956156379
COCCCN1C(=O)(C@H)2(C@@H)(C1=O)C1(NC2Cc2c(nH)c3c2cccc3)C(=O)Nc2c1cc(Cl)cc2
InChI=1SC26H25ClN4O4c13510493123(32)2120(1114132818632516(14)18)3026(22(21)24(31)33)171215(27)7819(17)2925(26)34h2358121320222830H4911H21H3(H2934)t20?2122+26?m1s1
MFCD06770281
ZINC000015970375
ZINC000020757402
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.