Vitas-M small molecule compound
(3a'S,6a'R)-5-bromo-5'-(butan-2-yl)-3'-methyl-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
STK576112
SMILES CCC(N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C)C(=O)Nc2c1cc(Br)cc2)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 C18H20BrN3O3 MW 406.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20BrN3O3/c1-4-8(2)22-15(23)13-9(3)21-18(14(13)16(22)24)11-7-10(19)5-6-12(11)20-17(18)25/h5-9,13-14,21H,4H2,1-3H3,(H,20,25)/t8?,9?,13-,14+,18?/m1/s1InChIKey
USHOXFDLHHVRMJ-XXBYOFQQSA-NSynonyms
1212452-36-2(3aR6aS)5bromo5butan2yl1methylspiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)246trione
(3aS6aR)5bromo5(butan2yl)3methyl3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
(3aS6aR)5bromo5(secbutyl)3methyl33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
1212452362
CCC(C)N1C(=O)C2C(NC3(C2C1=O)C4=C(C=CC(=C4)Br)NC3=O)C
CCC(N1C(=O)(C@H)2(C@@H)(C1=O)C1(NC2C)C(=O)Nc2c1cc(Br)cc2)C
InChI=1SC18H20BrN3O3c148(2)2215(23)139(3)2118(14(13)16(22)24)11710(19)5612(11)2017(18)25h59131421H4H213H3(H2025)t8?9?1314+18?m1s1
MFCD06787266
ZINC000005346192
ZINC000035375156
Check stock
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