Vitas-M small molecule compound

2-{(3R,3'S,3a'S,6a'R)-2,4',6'-trioxo-5'-[2-(trifluoromethyl)phenyl]-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl}acetamide

Catalog ID
STK573753
SMILES NC(=O)C[C@@H]1N[C@@]2([C@H]3[C@@H]1C(=O)N(C3=O)c1ccccc1C(F)(F)F)C(=O)Nc1c2cccc1

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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 C22H17F3N4O4 MW 458.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17F3N4O4/c23-22(24,25)11-6-2-4-8-14(11)29-18(31)16-13(9-15(26)30)28-21(17(16)19(29)32)10-5-1-3-7-12(10)27-20(21)33/h1-8,13,16-17,28H,9H2,(H2,26,30)(H,27,33)/t13-,16+,17-,21-/m0/s1
InChIKey
KUDNVCBQYVEFHW-ACWWSVHNSA-N
Synonyms
1014068-70-2
1014068702
2((1R3S3aS6aR)246trioxo5(2(trifluoromethyl)phenyl)33a4566ahexahydro2Hspiro(indoline31pyrrolo(34c)pyrrol)3yl)acetamide
2((1S3R3AR6AS)246TRIOXO5(2(TRIFLUOROMETHYL)PHENYL)SPIRO(123A6ATETRAHYDROPYRROLO(34C)PYRROLE331HINDOLE)1YL)ACETAMIDE
2((3R3S3aS6aR)246trioxo5(2(trifluoromethyl)phenyl)1233a4566aoctahydro2Hspiro(indole31pyrrolo(34c)pyrrol)3yl)acetamide
C1=CC=C2C(=C1)C3(C4C(C(N3)CC(=O)N)C(=O)N(C4=O)C5=CC=CC=C5C(F)(F)F)C(=O)N2
InChI=1SC22H17F3N4O4c2322(2425)11624814(11)2918(31)1613(915(26)30)2821(17(16)19(29)32)10513712(10)2720(21)33h1813161728H9H2(H22630)(H2733)t1316+1721m0s1
MFCD18245488
NC(=O)C(C@@H)1N(C@@)2((C@H)3(C@@H)1C(=O)N(C3=O)c1ccccc1C(F)(F)F)C(=O)Nc1c2cccc1
ZINC000016010281
ZINC16010281

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Available files

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