Vitas-M small molecule compound

(3a'R,6a'S)-3'-(2-methylpropyl)-5'-[2-(trifluoromethyl)phenyl]-3a',6a'-dihydro-2'H,12H-spiro[indolo[2,1-b]quinazoline-6,1'-pyrrolo[3,4-c]pyrrole]-4',6',12(3'H,5'H)-trione

Catalog ID
STL569916
SMILES CC(CC1NC2([C@@H]3[C@H]1C(=O)N(C3=O)c1ccccc1C(F)(F)F)c1ccccc1n1c2nc2ccccc2c1=O)C

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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 C31H25F3N4O3 MW 558.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H25F3N4O3/c1-16(2)15-21-24-25(28(41)37(27(24)40)23-14-8-5-11-19(23)31(32,33)34)30(36-21)18-10-4-7-13-22(18)38-26(39)17-9-3-6-12-20(17)35-29(30)38/h3-14,16,21,24-25,36H,15H2,1-2H3/t21?,24-,25+,30?/m0/s1
InChIKey
MPDMUKBWBMNURO-IYJQVCBOSA-N
Synonyms
1177503-68-2
(3aR6aS)3(2methylpropyl)5(2(trifluoromethyl)phenyl)3a6adihydro2H12Hspiro(indolo(21b)quinazoline61pyrrolo(34c)pyrrole)4612(3H5H)trione
(3aR6aS)3isobutyl5(2(trifluoromethyl)phenyl)33adihydro2H12Hspiro(indolo(21b)quinazoline61pyrrolo(34c)pyrrole)4612(5H6aH)trione
(3aS6aR)1(2methylpropyl)5(2(trifluoromethyl)phenyl)spiro(123a6atetrahydropyrrolo(34c)pyrrole36indolo(21b)quinazoline)4612trione
1177503682
17602135
CC(CC1NC2((C@@H)3(C@H)1C(=O)N(C3=O)c1ccccc1C(F)(F)F)c1ccccc1n1c2nc2ccccc2c1=O)C
InChI=1SC31H25F3N4O3c116(2)15212425(28(41)37(27(24)40)2314851119(23)31(3233)34)30(3621)1810471322(18)3826(39)179361220(17)3529(30)38h3141621242536H15H212H3t21?2425+30?m0s1
ZINC000101508674
ZINC000101508678

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Available files

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