Vitas-M small molecule compound
(3a'S,6a'R)-7-chloro-3'-(4-hydroxybenzyl)-5'-(2-methoxyethyl)-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
STK575298
SMILES COCCN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2ccc(cc2)O)C(=O)Nc2c1cccc2Cl
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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 C23H22ClN3O5 MW 455.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22ClN3O5/c1-32-10-9-27-20(29)17-16(11-12-5-7-13(28)8-6-12)26-23(18(17)21(27)30)14-3-2-4-15(24)19(14)25-22(23)31/h2-8,16-18,26,28H,9-11H2,1H3,(H,25,31)/t16?,17-,18+,23?/m1/s1InChIKey
DOFYAHSTBWILHC-VQFNIZELSA-NSynonyms
1013751-46-6(3aR6aS)7chloro1((4hydroxyphenyl)methyl)5(2methoxyethyl)spiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)246trione
(3aS6aR)7chloro3(4hydroxybenzyl)5(2methoxyethyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)7chloro3(4hydroxybenzyl)5(2methoxyethyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
1013751466
COCCN1C(=O)(C@H)2(C@@H)(C1=O)C1(NC2Cc2ccc(cc2)O)C(=O)Nc2c1cccc2Cl
COCCN1C(=O)C2C(NC3(C2C1=O)C4=C(C(=CC=C4)Cl)NC3=O)CC5=CC=C(C=C5)O
InChI=1SC23H22ClN3O5c1321092720(29)1716(11125713(28)8612)2623(18(17)21(27)30)1432415(24)19(14)2522(23)31h2816182628H911H21H3(H2531)t16?1718+23?m1s1
MFCD06792352
ZINC000013575291
ZINC000016024915
Check stock
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Check stock on Vitas-MAvailable files
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