Vitas-M small molecule compound
2-[(3a'S,6a'R)-5-chloro-5'-(2-methoxybenzyl)-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
STL529799
SMILES COc1ccccc1CN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CC(=O)N)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 C23H21ClN4O5 MW 468.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21ClN4O5/c1-33-16-5-3-2-4-11(16)10-28-20(30)18-15(9-17(25)29)27-23(19(18)21(28)31)13-8-12(24)6-7-14(13)26-22(23)32/h2-8,15,18-19,27H,9-10H2,1H3,(H2,25,29)(H,26,32)/t15?,18-,19+,23?/m1/s1InChIKey
QKFJHLVMRDNTRF-QDCJGZBBSA-NSynonyms
956977-15-416402637
2((3~(a)~(R)6~(a)~(S))5chloro5((2methoxyphenyl)methyl)246trioxospiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)1yl)acetamide
2((3aS6aR)5chloro5(2methoxybenzyl)246trioxo1233a4566aoctahydro2Hspiro(indole31pyrrolo(34c)pyrrol)3yl)acetamide
2((3aS6aR)5chloro5(2methoxybenzyl)246trioxo33a4566ahexahydro2Hspiro(indoline31pyrrolo(34c)pyrrol)3yl)acetamide
956977154
COc1ccccc1CN1C(=O)(C@H)2(C@@H)(C1=O)C1(NC2CC(=O)N)C(=O)Nc2c1cc(Cl)cc2
InChI=1SC23H21ClN4O5c13316532411(16)102820(30)1815(917(25)29)2723(19(18)21(28)31)13812(24)6714(13)2622(23)32h2815181927H910H21H3(H22529)(H2632)t15?1819+23?m1s1
MFCD06494058
ZINC000015957653
ZINC000020611037
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.