Vitas-M small molecule compound
(3a'S,6a'R)-5-fluoro-3'-(1-hydroxyethyl)-5'-(4-methoxybenzyl)-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
STK596733
SMILES COc1ccc(cc1)CN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C(O)C)C(=O)Nc2c1cc(F)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 C23H22FN3O5 MW 439.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22FN3O5/c1-11(28)19-17-18(23(26-19)15-9-13(24)5-8-16(15)25-22(23)31)21(30)27(20(17)29)10-12-3-6-14(32-2)7-4-12/h3-9,11,17-19,26,28H,10H2,1-2H3,(H,25,31)/t11?,17-,18-,19?,23?/m0/s1InChIKey
BUPDNDBUWANODG-SUEOTQAISA-NSynonyms
1214624-20-0(3aR6aS)5fluoro1(1hydroxyethyl)5((4methoxyphenyl)methyl)spiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)246trione
(3aS6aR)5fluoro3(1hydroxyethyl)5(4methoxybenzyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)5fluoro3(1hydroxyethyl)5(4methoxybenzyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
1214624200
CC(C1C2C(C(=O)N(C2=O)CC3=CC=C(C=C3)OC)C4(N1)C5=C(C=CC(=C5)F)NC4=O)O
COc1ccc(cc1)CN1C(=O)(C@H)2(C@@H)(C1=O)C1(NC2C(O)C)C(=O)Nc2c1cc(F)cc2
InChI=1SC23H22FN3O5c111(28)191718(23(2619)15913(24)5816(15)2522(23)31)21(30)27(20(17)29)10123614(322)7412h391117192628H10H212H3(H2531)t11?171819?23?m0s1
MFCD06777041
ZINC000016020879
ZINC000229881311
Check stock
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Check stock on Vitas-MAvailable files
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