Vitas-M small molecule compound
5-chloro-3-hydroxy-1-methyl-3-[(3E,5E)-2-oxo-6-phenylhexa-3,5-dien-1-yl]-1,3-dihydro-2H-indol-2-one
Catalog ID
STK212911
SMILES O=C(CC1(O)c2cc(Cl)ccc2N(C1=O)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 C21H18ClNO3 MW 367.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClNO3/c1-23-19-12-11-16(22)13-18(19)21(26,20(23)25)14-17(24)10-6-5-9-15-7-3-2-4-8-15/h2-13,26H,14H2,1H3/b9-5+,10-6+InChIKey
UWACZYOBENUMQP-NXZHAISVSA-NSynonyms
3((3E5E)2OXO6PHENYLHEXA35DIENYL)5CHLORO3HYDROXY1METHYLINDOLIN2ONE
5chloro3hydroxy1methyl3((3E5E)2oxo6phenylhexa35dien1yl)13dihydro2Hindol2one
5CHLORO3HYDROXY1METHYL3((3E5E)2OXO6PHENYLHEXA35DIENYL)INDOL2ONE
5CHLORO3HYDROXY1METHYL3(2OXO6PHENYL35HEXADIENYL)13DIHYDRO2HINDOL2ONE
CN1C2=C(C=C(C=C2)Cl)C(C1=O)(CC(=O)C=CC=CC3=CC=CC=C3)O
InChI=1SC21H18ClNO3c12319121116(22)1318(19)21(2620(23)25)1417(24)10659157324815h21326H14H21H3b95+106+
MFCD04041639
O=C(CC1(O)c2cc(Cl)ccc2N(C1=O)C)C=CC=Cc1ccccc1
ZINC000004555363
ZINC000004555364
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