Vitas-M small molecule compound
5-bromo-3-[2-(4-tert-butylphenyl)-2-oxoethyl]-3-hydroxy-1,3-dihydro-2H-indol-2-one
Catalog ID
STK086359
SMILES Brc1ccc2c(c1)C(O)(CC(=O)c1ccc(cc1)C(C)(C)C)C(=O)N2
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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 C20H20BrNO3 MW 402.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20BrNO3/c1-19(2,3)13-6-4-12(5-7-13)17(23)11-20(25)15-10-14(21)8-9-16(15)22-18(20)24/h4-10,25H,11H2,1-3H3,(H,22,24)InChIKey
LJLSMGUEFUTUQN-UHFFFAOYSA-NSynonyms
(3R)5BROMO3(2(4TERTBUTYLPHENYL)2OXOETHYL)3HYDROXY13DIHYDRO2HINDOL2ONE
(3S)5BROMO3(2(4TERTBUTYLPHENYL)2OXOETHYL)3HYDROXY13DIHYDRO2HINDOL2ONE
3(2(4(TERTBUTYL)PHENYL)2OXOETHYL)5BROMO3HYDROXYINDOLIN2ONE
5BROMO3(2(4TERTBUTYLPHENYL)2OXOETHYL)3HYDROXY13DIHYDRO2HINDOL2ONE
5BROMO3(2(4TERTBUTYLPHENYL)2OXOETHYL)3HYDROXY1HINDOL2ONE
Brc1ccc2c(c1)C(O)(CC(=O)c1ccc(cc1)C(C)(C)C)C(=O)N2
CC(C)(C)C1=CC=C(C=C1)C(=O)CC2(C3=C(C=CC(=C3)Br)NC2=O)O
InChI=1SC20H20BrNO3c119(23)136412(5713)17(23)1120(25)151014(21)8916(15)2218(20)24h41025H11H213H3(H2224)
MFCD02641106
STK086359
ZINC000000989837
ZINC000000989838
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