Vitas-M small molecule compound
3-[(3a'S,6a'R)-5-fluoro-5'-(4-fluorobenzyl)-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
STK588687
SMILES NC(=O)CCC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)Cc1ccc(cc1)F)C(=O)Nc1c2cc(F)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 C23H20F2N4O4 MW 454.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20F2N4O4/c24-12-3-1-11(2-4-12)10-29-20(31)18-16(7-8-17(26)30)28-23(19(18)21(29)32)14-9-13(25)5-6-15(14)27-22(23)33/h1-6,9,16,18-19,28H,7-8,10H2,(H2,26,30)(H,27,33)/t16?,18-,19+,23?/m1/s1InChIKey
YGEMHOQQZJCGIN-PBHGZRDXSA-NSynonyms
1014020-88-21014020882
3((3aR6aS)5fluoro5((4fluorophenyl)methyl)246trioxospiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)1yl)propanamide
3((3aS6aR)5fluoro5(4fluorobenzyl)246trioxo1233a4566aoctahydro2Hspiro(indole31pyrrolo(34c)pyrrol)3yl)propanamide
3((3aS6aR)5fluoro5(4fluorobenzyl)246trioxo33a4566ahexahydro2Hspiro(indoline31pyrrolo(34c)pyrrol)3yl)propanamide
C1=CC(=CC=C1CN2C(=O)C3C(NC4(C3C2=O)C5=C(C=CC(=C5)F)NC4=O)CCC(=O)N)F
InChI=1SC23H20F2N4O4c24123111(2412)102920(31)1816(7817(26)30)2823(19(18)21(29)32)14913(25)5615(14)2722(23)33h16916181928H7810H2(H22630)(H2733)t16?1819+23?m1s1
MFCD06775067
NC(=O)CCC1NC2((C@H)3(C@@H)1C(=O)N(C3=O)Cc1ccc(cc1)F)C(=O)Nc1c2cc(F)cc1
ZINC000016020621
ZINC000016020627
Check stock
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Check stock on Vitas-MAvailable files
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