Vitas-M small molecule compound
(3a'S,6a'R)-5'-tert-butyl-7-chloro-3'-(4-hydroxybenzyl)-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
STK586045
SMILES Oc1ccc(cc1)CC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)C(C)(C)C)C(=O)Nc1c2cccc1Cl
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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 C24H24ClN3O4 MW 453.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24ClN3O4/c1-23(2,3)28-20(30)17-16(11-12-7-9-13(29)10-8-12)27-24(18(17)21(28)31)14-5-4-6-15(25)19(14)26-22(24)32/h4-10,16-18,27,29H,11H2,1-3H3,(H,26,32)/t16?,17-,18+,24?/m1/s1InChIKey
SXZSKKHMFRXSMB-NNZNXZITSA-NSynonyms
1013754-38-5(3aR6aS)5tertbutyl7chloro1((4hydroxyphenyl)methyl)spiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)246trione
(3aS6aR)5(tertbutyl)7chloro3(4hydroxybenzyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)5tertbutyl7chloro3(4hydroxybenzyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
1013754385
CC(C)(C)N1C(=O)C2C(NC3(C2C1=O)C4=C(C(=CC=C4)Cl)NC3=O)CC5=CC=C(C=C5)O
InChI=1SC24H24ClN3O4c123(23)2820(30)1716(11127913(29)10812)2724(18(17)21(28)31)1454615(25)19(14)2622(24)32h41016182729H11H213H3(H2632)t16?1718+24?m1s1
MFCD06793788
Oc1ccc(cc1)CC1NC2((C@H)3(C@@H)1C(=O)N(C3=O)C(C)(C)C)C(=O)Nc1c2cccc1Cl
ZINC000013575946
ZINC000020567077
Check stock
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Check stock on Vitas-MAvailable files
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