Vitas-M small molecule compound
2-[(3a'S,6a'R)-5'-(2-methoxyethyl)-5,7-dimethyl-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]acetamide
Catalog ID
STK598834
SMILES COCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CC(=O)N)C(=O)Nc2c1cc(C)cc2C
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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 C20H24N4O5 MW 400.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N4O5/c1-9-6-10(2)16-11(7-9)20(19(28)22-16)15-14(12(23-20)8-13(21)25)17(26)24(18(15)27)4-5-29-3/h6-7,12,14-15,23H,4-5,8H2,1-3H3,(H2,21,25)(H,22,28)/t12?,14-,15+,20?/m1/s1InChIKey
CNDRAIMKSNTWMT-YCXMQWEZSA-NSynonyms
1212432-07-91212432079
2((3aR6aS)5(2methoxyethyl)57dimethyl246trioxospiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)1yl)acetamide
2((3aS6aR)5(2methoxyethyl)57dimethyl246trioxo1233a4566aoctahydro2Hspiro(indole31pyrrolo(34c)pyrrol)3yl)acetamide
2((3aS6aR)5(2methoxyethyl)57dimethyl246trioxo33a4566ahexahydro2Hspiro(indoline31pyrrolo(34c)pyrrol)3yl)acetamide
CC1=CC(=C2C(=C1)C3(C4C(C(N3)CC(=O)N)C(=O)N(C4=O)CCOC)C(=O)N2)C
COCCN1C(=O)(C@H)2(C@@H)(C1=O)C1(NC2CC(=O)N)C(=O)Nc2c1cc(C)cc2C
InChI=1SC20H24N4O5c19610(2)1611(79)20(19(28)2216)1514(12(2320)813(21)25)17(26)24(18(15)27)45293h6712141523H458H213H3(H22125)(H2228)t12?1415+20?m1s1
MFCD06785117
ZINC000016021985
ZINC000020548533
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.