Vitas-M small molecule compound
1-(1,3-benzodioxol-5-ylmethyl)-3-hydroxy-3-{2-oxo-2-[4-(propan-2-yl)phenyl]ethyl}-1,3-dihydro-2H-indol-2-one
Catalog ID
STK214795
SMILES O=C1N(Cc2ccc3c(c2)OCO3)c2c(C1(O)CC(=O)c1ccc(cc1)C(C)C)cccc2
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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 C27H25NO5 MW 443.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25NO5/c1-17(2)19-8-10-20(11-9-19)23(29)14-27(31)21-5-3-4-6-22(21)28(26(27)30)15-18-7-12-24-25(13-18)33-16-32-24/h3-13,17,31H,14-16H2,1-2H3InChIKey
XMJLDPFAZQEKNQ-UHFFFAOYSA-NSynonyms
1(13BENZODIOXOL5YLMETHYL)3HYDROXY3(2(4(1METHYLETHYL)PHENYL)2OXOETHYL)13DIHYDRO2HINDOL2ONE
1(13BENZODIOXOL5YLMETHYL)3HYDROXY3(2OXO2(4(PROPAN2YL)PHENYL)ETHYL)13DIHYDRO2HINDOL2ONE
1(13BENZODIOXOL5YLMETHYL)3HYDROXY3(2OXO2(4PROPAN2YLPHENYL)ETHYL)INDOL2ONE
1(2HBENZO(34D)13DIOXOLAN5YLMETHYL)3HYDROXY3(2(4(METHYLETHYL)PHENYL)2OXOETHYL)INDOLIN2ONE
CC(C)C1=CC=C(C=C1)C(=O)CC2(C3=CC=CC=C3N(C2=O)CC4=CC5=C(C=C4)OCO5)O
InChI=1SC27H25NO5c117(2)1981020(11919)23(29)1427(31)21534622(21)28(26(27)30)15187122425(1318)33163224h3131731H1416H212H3
MFCD02916232
ZINC000010059154
ZINC000010059155
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