Vitas-M small molecule compound

3-[(3a'S,6a'R)-5'-(2-methoxyethyl)-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
STL535181
SMILES COCCN1C(=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 C20H24N4O5 MW 400.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N4O5/c1-10-4-3-5-11-16(10)22-19(28)20(11)15-14(12(23-20)6-7-13(21)25)17(26)24(18(15)27)8-9-29-2/h3-5,12,14-15,23H,6-9H2,1-2H3,(H2,21,25)(H,22,28)/t12?,14-,15+,20?/m1/s1
InChIKey
UEXJIPYCFBYMMO-YCXMQWEZSA-N
Synonyms
1014083-18-1
1014083181
17572235
3((3~(a)~(R)6~(a)~(S))5(2methoxyethyl)7methyl246trioxospiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)1yl)propanamide
3((3aS6aR)5(2methoxyethyl)7methyl246trioxo1233a4566aoctahydro2Hspiro(indole31pyrrolo(34c)pyrrol)3yl)propanamide
3((3aS6aR)5(2methoxyethyl)7methyl246trioxo33a4566ahexahydro2Hspiro(indoline31pyrrolo(34c)pyrrol)3yl)propanamide
COCCN1C(=O)(C@H)2(C@@H)(C1=O)C1(NC2CCC(=O)N)C(=O)Nc2c1cccc2C
InChI=1SC20H24N4O5c1104351116(10)2219(28)20(11)1514(12(2320)6713(21)25)17(26)24(18(15)27)89292h3512141523H69H212H3(H22125)(H2228)t12?1415+20?m1s1
MFCD06785119
ZINC000020760352
ZINC000020760365

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.