Vitas-M small molecule compound
3-[(3a'S,6a'R)-5'-(4-methoxybenzyl)-7-methyl-2,4',6'-trioxo-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]propanamide
Catalog ID
STL532681
SMILES COc1ccc(cc1)CN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CCC(=O)N)C(=O)Nc2c1cccc2C
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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 C25H26N4O5 MW 462.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O5/c1-13-4-3-5-16-21(13)27-24(33)25(16)20-19(17(28-25)10-11-18(26)30)22(31)29(23(20)32)12-14-6-8-15(34-2)9-7-14/h3-9,17,19-20,28H,10-12H2,1-2H3,(H2,26,30)(H,27,33)/t17?,19-,20+,25?/m1/s1InChIKey
JRIUJIJAVODGTL-UIMQCXHPSA-NSynonyms
956992-90-816405072
3((3~(a)~(R)6~(a)~(S))5((4methoxyphenyl)methyl)7methyl246trioxospiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)1yl)propanamide
3((3aS6aR)5(4methoxybenzyl)7methyl246trioxo1233a4566aoctahydro2Hspiro(indole31pyrrolo(34c)pyrrol)3yl)propanamide
3((3aS6aR)5(4methoxybenzyl)7methyl246trioxo33a4566ahexahydro2Hspiro(indoline31pyrrolo(34c)pyrrol)3yl)propanamide
956992908
COc1ccc(cc1)CN1C(=O)(C@H)2(C@@H)(C1=O)C1(NC2CCC(=O)N)C(=O)Nc2c1cccc2C
InChI=1SC25H26N4O5c1134351621(13)2724(33)25(16)2019(17(2825)101118(26)30)22(31)29(23(20)32)12146815(342)9714h3917192028H1012H212H3(H22630)(H2733)t17?1920+25?m1s1
MFCD06768933
ZINC000016033038
ZINC000020756370
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.