Vitas-M small molecule compound
1-(2,5-dimethylbenzyl)-3-hydroxy-3-[(3E)-2-oxo-4-phenylbut-3-en-1-yl]-1,3-dihydro-2H-indol-2-one
Catalog ID
STK273086
SMILES O=C(CC1(O)c2ccccc2N(C1=O)Cc1cc(C)ccc1C)/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 C27H25NO3 MW 411.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25NO3/c1-19-12-13-20(2)22(16-19)18-28-25-11-7-6-10-24(25)27(31,26(28)30)17-23(29)15-14-21-8-4-3-5-9-21/h3-16,31H,17-18H2,1-2H3/b15-14+InChIKey
PVOSXLYXNFVXSP-CCEZHUSRSA-NSynonyms
1((25DIMETHYLPHENYL)METHYL)3HYDROXY3((E)2OXO4PHENYLBUT3ENYL)INDOL2ONE
1(25dimethylbenzyl)3hydroxy3((3E)2oxo4phenylbut3en1yl)13dihydro2Hindol2one
1(25DIMETHYLBENZYL)3HYDROXY3(2OXO4PHENYL3BUTENYL)13DIHYDRO2HINDOL2ONE
3((3E)2OXO4PHENYLBUT3ENYL)1((25DIMETHYLPHENYL)METHYL)3HYDROXYINDOLIN2ONE
CC1=CC(=C(C=C1)C)CN2C3=CC=CC=C3C(C2=O)(CC(=O)C=CC4=CC=CC=C4)O
InChI=1SC27H25NO3c119121320(2)22(1619)18282511761024(25)27(3126(28)30)1723(29)1514218435921h31631H1718H212H3b1514+
MFCD04042346
O=C(CC1(O)c2ccccc2N(C1=O)Cc1cc(C)ccc1C)C=Cc1ccccc1
ZINC000004556274
ZINC000004556275
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