Vitas-M small molecule compound
5-bromo-3-hydroxy-1-[2-methyl-5-(propan-2-yl)benzyl]-3-[(3E,5E)-2-oxo-6-phenylhexa-3,5-dien-1-yl]-1,3-dihydro-2H-indol-2-one
Catalog ID
STK273098
SMILES O=C(CC1(O)C(=O)N(c2c1cc(Br)cc2)Cc1cc(ccc1C)C(C)C)/C=C/C=C/c1ccccc1
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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 C31H30BrNO3 MW 544.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30BrNO3/c1-21(2)24-14-13-22(3)25(17-24)20-33-29-16-15-26(32)18-28(29)31(36,30(33)35)19-27(34)12-8-7-11-23-9-5-4-6-10-23/h4-18,21,36H,19-20H2,1-3H3/b11-7+,12-8+InChIKey
JHDKNMXLKLIMJB-MKICQXMISA-NSynonyms
3((3E5E)2OXO6PHENYLHEXA35DIENYL)5BROMO3HYDROXY1((2METHYL5(METHYLETHYL)PHENYL)METHYL)INDOLIN2ONE
5BROMO3HYDROXY1((2METHYL5PROPAN2YLPHENYL)METHYL)3((3E5E)2OXO6PHENYLHEXA35DIENYL)INDOL2ONE
5bromo3hydroxy1(2methyl5(propan2yl)benzyl)3((3E5E)2oxo6phenylhexa35dien1yl)13dihydro2Hindol2one
CC1=C(C=C(C=C1)C(C)C)CN2C3=C(C=C(C=C3)Br)C(C2=O)(CC(=O)C=CC=CC4=CC=CC=C4)O
InChI=1SC31H30BrNO3c121(2)24141322(3)25(1724)203329161526(32)1828(29)31(3630(33)35)1927(34)1287112395461023h4182136H1920H213H3b117+128+
MFCD05661472
O=C(CC1(O)C(=O)N(c2c1cc(Br)cc2)Cc1cc(ccc1C)C(C)C)C=CC=Cc1ccccc1
ZINC000097962084
ZINC000097962085
Check stock
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