Vitas-M small molecule compound
(3a'R,8b'S)-2'-(butan-2-yl)-5-chloro-3a',6',7',8',8a',8b'-hexahydro-1'H-spiro[indole-3,4'-pyrrolo[3,4-a]pyrrolizine]-1',2,3'(1H,2'H)-trione
Catalog ID
STK580225
SMILES CCC(N1C(=O)[C@H]2[C@@H](C1=O)C1(N3C2CCC3)C(=O)Nc2c1cc(Cl)cc2)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 C20H22ClN3O3 MW 387.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22ClN3O3/c1-3-10(2)24-17(25)15-14-5-4-8-23(14)20(16(15)18(24)26)12-9-11(21)6-7-13(12)22-19(20)27/h6-7,9-10,14-16H,3-5,8H2,1-2H3,(H,22,27)/t10?,14?,15-,16+,20?/m1/s1InChIKey
CMNIEODQDVRHSD-KTBVGEPESA-NSynonyms
1212486-57-1(3aR8bS)2(butan2yl)5chloro3a6788a8bhexahydro1Hspiro(indole34pyrrolo(34a)pyrrolizine)123(1H2H)trione
(3aR8bS)2(secbutyl)5chloro6788atetrahydro1Hspiro(indoline34pyrrolo(34a)pyrrolizine)123(2H3aH8bH)trione
(3aR8bS)2butan2yl5chlorospiro(1Hindole343a6788a8bhexahydropyrrolo(34a)pyrrolizine)123trione
1212486571
CCC(C)N1C(=O)C2C3CCCN3C4(C2C1=O)C5=C(C=CC(=C5)Cl)NC4=O
CCC(N1C(=O)(C@H)2(C@@H)(C1=O)C1(N3C2CCC3)C(=O)Nc2c1cc(Cl)cc2)C
InChI=1SC20H22ClN3O3c1310(2)2417(25)151454823(14)20(16(15)18(24)26)12911(21)6713(12)2219(20)27h679101416H358H212H3(H2227)t10?14?1516+20?m1s1
MFCD06794073
ZINC000013576121
ZINC000227050807
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.