Vitas-M small molecule compound
(3a'R,6a'S)-5'-(3-methoxyphenyl)-3'-(2-methylpropyl)-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
STL566011
SMILES COc1cccc(c1)N1C(=O)[C@@H]2[C@H](C1=O)C1(NC2CC(C)C)c2ccccc2n2c1nc1ccccc1c2=O
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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 C31H28N4O4 MW 520.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28N4O4/c1-17(2)15-23-25-26(29(38)34(28(25)37)18-9-8-10-19(16-18)39-3)31(33-23)21-12-5-7-14-24(21)35-27(36)20-11-4-6-13-22(20)32-30(31)35/h4-14,16-17,23,25-26,33H,15H2,1-3H3/t23?,25-,26+,31?/m0/s1InChIKey
GZPVYIQOYKXUSP-MXMWHYQXSA-NSynonyms
1177456-28-8(3aR6aS)3isobutyl5(3methoxyphenyl)33adihydro2H12Hspiro(indolo(21b)quinazoline61pyrrolo(34c)pyrrole)4612(5H6aH)trione
(3aR6aS)5(3methoxyphenyl)3(2methylpropyl)3a6adihydro2H12Hspiro(indolo(21b)quinazoline61pyrrolo(34c)pyrrole)4612(3H5H)trione
(3aS6aR)5(3methoxyphenyl)1(2methylpropyl)spiro(123a6atetrahydropyrrolo(34c)pyrrole36indolo(21b)quinazoline)4612trione
1177456288
17572057
COc1cccc(c1)N1C(=O)(C@@H)2(C@H)(C1=O)C1(NC2CC(C)C)c2ccccc2n2c1nc1ccccc1c2=O
InChI=1SC31H28N4O4c117(2)15232526(29(38)34(28(25)37)18981019(1618)393)31(3323)2112571424(21)3527(36)2011461322(20)3230(31)35h414161723252633H15H213H3t23?2526+31?m0s1
ZINC000070712246
ZINC000070712249
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.