Vitas-M small molecule compound
2-[(3R,3'S,3a'S,6a'R)-5'-(3-chloro-4-fluorophenyl)-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]acetamide
Catalog ID
STK594926
SMILES NC(=O)C[C@@H]1N[C@@]2([C@H]3[C@@H]1C(=O)N(C3=O)c1ccc(c(c1)Cl)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 C21H16ClFN4O4 MW 442.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16ClFN4O4/c22-11-7-9(5-6-12(11)23)27-18(29)16-14(8-15(24)28)26-21(17(16)19(27)30)10-3-1-2-4-13(10)25-20(21)31/h1-7,14,16-17,26H,8H2,(H2,24,28)(H,25,31)/t14-,16+,17-,21-/m0/s1InChIKey
ZHQYWYBWLDLABC-CCFTVXDOSA-NSynonyms
1014067-03-81014067038
2((1R3S3aS6aR)5(3chloro4fluorophenyl)246trioxo33a4566ahexahydro2Hspiro(indoline31pyrrolo(34c)pyrrol)3yl)acetamide
2((1S3R3AR6AS)5(3CHLORO4FLUOROPHENYL)246TRIOXOSPIRO(123A6ATETRAHYDROPYRROLO(34C)PYRROLE331HINDOLE)1YL)ACETAMIDE
2((3R3S3aS6aR)5(3chloro4fluorophenyl)246trioxo1233a4566aoctahydro2Hspiro(indole31pyrrolo(34c)pyrrol)3yl)acetamide
C1=CC=C2C(=C1)C3(C4C(C(N3)CC(=O)N)C(=O)N(C4=O)C5=CC(=C(C=C5)F)Cl)C(=O)N2
InChI=1SC21H16ClFN4O4c221179(5612(11)23)2718(29)1614(815(24)28)2621(17(16)19(27)30)10312413(10)2520(21)31h1714161726H8H2(H22428)(H2531)t1416+1721m0s1
MFCD18246000
NC(=O)C(C@@H)1N(C@@)2((C@H)3(C@@H)1C(=O)N(C3=O)c1ccc(c(c1)Cl)F)C(=O)Nc1c2cccc1
ZINC000016010005
ZINC16010005
Check stock
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Check stock on Vitas-MAvailable files
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