Vitas-M small molecule compound

(3a'S,6a'R)-5'-(4-bromophenyl)-5-fluoro-3'-(4-hydroxybenzyl)-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
STK573240
SMILES Fc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)c1ccc(cc1)Br)Cc1ccc(cc1)O)C(=O)N2

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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 C26H19BrFN3O4 MW 536.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19BrFN3O4/c27-14-3-6-16(7-4-14)31-23(33)21-20(11-13-1-8-17(32)9-2-13)30-26(22(21)24(31)34)18-12-15(28)5-10-19(18)29-25(26)35/h1-10,12,20-22,30,32H,11H2,(H,29,35)/t20?,21-,22+,26?/m1/s1
InChIKey
QFVWUACWUCVRMY-YPHDTHBOSA-N
Synonyms
1013871-67-4
(3aR6aS)5(4bromophenyl)5fluoro1((4hydroxyphenyl)methyl)spiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)246trione
(3aS6aR)5(4bromophenyl)5fluoro3(4hydroxybenzyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)5(4bromophenyl)5fluoro3(4hydroxybenzyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
1013871674
C1=CC(=CC=C1CC2C3C(C(=O)N(C3=O)C4=CC=C(C=C4)Br)C5(N2)C6=C(C=CC(=C6)F)NC5=O)O
Fc1ccc2c(c1)C1(NC((C@@H)3(C@H)1C(=O)N(C3=O)c1ccc(cc1)Br)Cc1ccc(cc1)O)C(=O)N2
InChI=1SC26H19BrFN3O4c27143616(7414)3123(33)2120(11131817(32)9213)3026(22(21)24(31)34)181215(28)51019(18)2925(26)35h1101220223032H11H2(H2935)t20?2122+26?m1s1
MFCD06591754
ZINC000101257338
ZINC000101257352

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Available files

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