Vitas-M small molecule compound
5'-(2-bromo-4-methylphenyl)-3'-[2-(methylsulfanyl)ethyl]-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
STL049090
SMILES CSCCC1NC2(C3C1C(=O)N(C3=O)c1ccc(cc1Br)C)C(=O)Nc1c2cccc1
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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 C23H22BrN3O3S MW 500.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22BrN3O3S/c1-12-7-8-17(14(24)11-12)27-20(28)18-16(9-10-31-2)26-23(19(18)21(27)29)13-5-3-4-6-15(13)25-22(23)30/h3-8,11,16,18-19,26H,9-10H2,1-2H3,(H,25,30)InChIKey
LPDOAJOSJXCMKY-UHFFFAOYSA-NSynonyms
(1R3S3aS6aR)5(2bromo4methylphenyl)3(2(methylthio)ethyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
5(2BROMO4METHYLPHENYL)1(2METHYLSULFANYLETHYL)SPIRO(123A6ATETRAHYDROPYRROLO(34C)PYRROLE331HINDOLE)246TRIONE
5(2bromo4methylphenyl)3(2(methylsulfanyl)ethyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
CC1=CC(=C(C=C1)N2C(=O)C3C(NC4(C3C2=O)C5=CC=CC=C5NC4=O)CCSC)Br
CSCC(C@@H)1N(C@@)2((C@H)3(C@@H)1C(=O)N(C3=O)c1ccc(cc1Br)C)C(=O)Nc1c2cccc1
InChI=1SC23H22BrN3O3Sc1127817(14(24)1112)2720(28)1816(910312)2623(19(18)21(27)29)13534615(13)2522(23)30h381116181926H910H212H3(H2530)
MFCD18192619
ZINC000016012832
ZINC000245246432
Check stock
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Check stock on Vitas-MAvailable files
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