Vitas-M small molecule compound
(3a'S,6a'R)-5-bromo-5'-butyl-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione
Catalog ID
STK585944
SMILES CCCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C(C)C)C(=O)Nc2c1cc(Br)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 C20H24BrN3O3 MW 434.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24BrN3O3/c1-4-5-8-24-17(25)14-15(18(24)26)20(23-16(14)10(2)3)12-9-11(21)6-7-13(12)22-19(20)27/h6-7,9-10,14-16,23H,4-5,8H2,1-3H3,(H,22,27)/t14-,15-,16?,20?/m0/s1InChIKey
QKWYHISIVFQWLP-OMMUHCLJSA-NSynonyms
1014063-24-1(3aR6aS)5bromo5butyl1propan2ylspiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)246trione
(3aS6aR)5bromo5butyl3(propan2yl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
(3aS6aR)5bromo5butyl3isopropyl33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
1014063241
CCCCN1C(=O)(C@H)2(C@@H)(C1=O)C1(NC2C(C)C)C(=O)Nc2c1cc(Br)cc2
CCCCN1C(=O)C2C(C1=O)C3(C4=C(C=CC(=C4)Br)NC3=O)NC2C(C)C
InChI=1SC20H24BrN3O3c14582417(25)1415(18(24)26)20(2316(14)10(2)3)12911(21)6713(12)2219(20)27h67910141623H458H213H3(H2227)t141516?20?m0s1
MFCD06788399
ZINC000016022264
ZINC000020565961
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.