Vitas-M small molecule compound

3-[(3a'S,6a'R)-5'-(2-chlorobenzyl)-6,7-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]propanoic acid

Catalog ID
STL533321
SMILES OC(=O)CCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)Cc1ccccc1Cl)C(=O)Nc1c2ccc(c1C)C

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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 C25H24ClN3O5 MW 481.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24ClN3O5/c1-12-7-8-15-21(13(12)2)27-24(34)25(15)20-19(17(28-25)9-10-18(30)31)22(32)29(23(20)33)11-14-5-3-4-6-16(14)26/h3-8,17,19-20,28H,9-11H2,1-2H3,(H,27,34)(H,30,31)/t17?,19-,20+,25?/m1/s1
InChIKey
HSQYHTRAVXDHOS-UIMQCXHPSA-N
Synonyms
956999-69-2
3((3~(a)~(R)6~(a)~(S))5((2chlorophenyl)methyl)67dimethyl246trioxospiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)1yl)propanoicacid
3((3aS6aR)5(2chlorobenzyl)67dimethyl246trioxo1233a4566aoctahydro2Hspiro(indole31pyrrolo(34c)pyrrol)3yl)propanoicacid
3((3aS6aR)5(2chlorobenzyl)67dimethyl246trioxo33a4566ahexahydro2Hspiro(indoline31pyrrolo(34c)pyrrol)3yl)propanoicacid
OC(=O)CCC1NC2((C@H)3(C@@H)1C(=O)N(C3=O)Cc1ccccc1Cl)C(=O)Nc1c2ccc(c1C)C
Registry IDs
MFCD06492699
ZINC000002127334
ZINC000002127339

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Available files

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