Vitas-M small molecule compound
(3S,3'S,3a'R,6a'S)-5-fluoro-3'-[(5-hydroxy-1H-indol-3-yl)methyl]-5'-phenyl-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
STK612923
SMILES Fc1ccc2c(c1)[C@]1(N[C@H]([C@H]3[C@@H]1C(=O)N(C3=O)c1ccccc1)Cc1c[nH]c3c1cc(O)cc3)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 C28H21FN4O4 MW 496.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21FN4O4/c29-15-6-8-21-19(11-15)28(27(37)31-21)24-23(25(35)33(26(24)36)16-4-2-1-3-5-16)22(32-28)10-14-13-30-20-9-7-17(34)12-18(14)20/h1-9,11-13,22-24,30,32,34H,10H2,(H,31,37)/t22-,23-,24+,28+/m0/s1InChIKey
KFSUJZMZRQLTIG-FLSMRUOLSA-NSynonyms
1014042-48-8(1S3S3aR6aS)5fluoro3((5hydroxy1Hindol3yl)methyl)5phenyl33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(1S3S3aS6aR)5fluoro1((5hydroxy1Hindol3yl)methyl)5phenylspiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)246trione
(3S3S3aR6aS)5fluoro3((5hydroxy1Hindol3yl)methyl)5phenyl3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
1014042488
C1=CC=C(C=C1)N2C(=O)C3C(NC4(C3C2=O)C5=C(C=CC(=C5)F)NC4=O)CC6=CNC7=C6C=C(C=C7)O
Fc1ccc2c(c1)(C@)1(N(C@H)((C@H)3(C@@H)1C(=O)N(C3=O)c1ccccc1)Cc1c(nH)c3c1cc(O)cc3)C(=O)N2
InChI=1SC28H21FN4O4c2915682119(1115)28(27(37)3121)2423(25(35)33(26(24)36)164213516)22(3228)10141330209717(34)1218(14)20h1911132224303234H10H2(H3137)t222324+28+m0s1
MFCD08284913
ZINC000020572816
ZINC20572816
Check stock
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