Vitas-M small molecule compound
3-[(3a'S,6a'R)-5-bromo-5'-tert-butyl-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
STK599055
SMILES NC(=O)CCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)C(C)(C)C)C(=O)Nc1c2cc(Br)cc1
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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 C20H23BrN4O4 MW 463.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23BrN4O4/c1-19(2,3)25-16(27)14-12(6-7-13(22)26)24-20(15(14)17(25)28)10-8-9(21)4-5-11(10)23-18(20)29/h4-5,8,12,14-15,24H,6-7H2,1-3H3,(H2,22,26)(H,23,29)/t12?,14-,15+,20?/m1/s1InChIKey
VEPWKNYQCGCHHZ-YCXMQWEZSA-NSynonyms
1014043-98-11014043981
3((3aR6aS)5bromo5tertbutyl246trioxospiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)1yl)propanamide
3((3aS6aR)5bromo5(tertbutyl)246trioxo33a4566ahexahydro2Hspiro(indoline31pyrrolo(34c)pyrrol)3yl)propanamide
3((3aS6aR)5bromo5tertbutyl246trioxo1233a4566aoctahydro2Hspiro(indole31pyrrolo(34c)pyrrol)3yl)propanamide
CC(C)(C)N1C(=O)C2C(NC3(C2C1=O)C4=C(C=CC(=C4)Br)NC3=O)CCC(=O)N
InChI=1SC20H23BrN4O4c119(23)2516(27)1412(6713(22)26)2420(15(14)17(25)28)1089(21)4511(10)2318(20)29h45812141524H67H213H3(H22226)(H2329)t12?1415+20?m1s1
MFCD06787745
NC(=O)CCC1NC2((C@H)3(C@@H)1C(=O)N(C3=O)C(C)(C)C)C(=O)Nc1c2cc(Br)cc1
ZINC000013573326
ZINC000016022200
Check stock
See real-time availability and sample size for STK599055 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.