Vitas-M small molecule compound

(3a'S,6a'R)-5-fluoro-3'-(4-hydroxybenzyl)-5'-(2-phenylethyl)-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
STK572925
SMILES Fc1ccc2c(c1)C1(NC([C@@H]3[C@H]1C(=O)N(C3=O)CCc1ccccc1)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 C28H24FN3O4 MW 485.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24FN3O4/c29-18-8-11-21-20(15-18)28(27(36)30-21)24-23(22(31-28)14-17-6-9-19(33)10-7-17)25(34)32(26(24)35)13-12-16-4-2-1-3-5-16/h1-11,15,22-24,31,33H,12-14H2,(H,30,36)/t22?,23-,24+,28?/m1/s1
InChIKey
PQDAMNOGOAJFQD-WUIRLBBUSA-N
Synonyms
1014066-40-0
(3aR6aS)5fluoro1((4hydroxyphenyl)methyl)5(2phenylethyl)spiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)246trione
(3aS6aR)5fluoro3(4hydroxybenzyl)5(2phenylethyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
(3aS6aR)5fluoro3(4hydroxybenzyl)5phenethyl33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
1014066400
C1=CC=C(C=C1)CCN2C(=O)C3C(NC4(C3C2=O)C5=C(C=CC(=C5)F)NC4=O)CC6=CC=C(C=C6)O
Fc1ccc2c(c1)C1(NC((C@@H)3(C@H)1C(=O)N(C3=O)CCc1ccccc1)Cc1ccc(cc1)O)C(=O)N2
InChI=1SC28H24FN3O4c29188112120(1518)28(27(36)3021)2423(22(3128)14176919(33)10717)25(34)32(26(24)35)1312164213516h1111522243133H1214H2(H3036)t22?2324+28?m1s1
MFCD06783164
ZINC000016021821
ZINC000016021824

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Available files

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