Vitas-M small molecule compound
3-[(3a'S,6a'R)-5'-(3-methoxypropyl)-5-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
STK575523
SMILES COCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2CCC(=O)N)C(=O)Nc2c1cc(C)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 C21H26N4O5 MW 414.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N4O5/c1-11-4-5-13-12(10-11)21(20(29)23-13)17-16(14(24-21)6-7-15(22)26)18(27)25(19(17)28)8-3-9-30-2/h4-5,10,14,16-17,24H,3,6-9H2,1-2H3,(H2,22,26)(H,23,29)/t14?,16-,17+,21?/m1/s1InChIKey
PMHUHHUBVGXDOS-ARMXKFQOSA-NSynonyms
1212472-72-41212472724
3((3aR6aS)5(3methoxypropyl)5methyl246trioxospiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)1yl)propanamide
3((3aS6aR)5(3methoxypropyl)5methyl246trioxo1233a4566aoctahydro2Hspiro(indole31pyrrolo(34c)pyrrol)3yl)propanamide
3((3aS6aR)5(3methoxypropyl)5methyl246trioxo33a4566ahexahydro2Hspiro(indoline31pyrrolo(34c)pyrrol)3yl)propanamide
CC1=CC2=C(C=C1)NC(=O)C23C4C(C(N3)CCC(=O)N)C(=O)N(C4=O)CCCOC
COCCCN1C(=O)(C@H)2(C@@H)(C1=O)C1(NC2CCC(=O)N)C(=O)Nc2c1cc(C)cc2
InChI=1SC21H26N4O5c111451312(1011)21(20(29)2313)1716(14(2421)6715(22)26)18(27)25(19(17)28)839302h451014161724H369H212H3(H22226)(H2329)t14?1617+21?m1s1
MFCD06787793
ZINC000016022206
ZINC000020565827
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.