Vitas-M small molecule compound

N-(2-{6-[(Z)-{1-[2-(4-fluorophenyl)ethyl]-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene}methyl]-7-methoxy-1,3-benzodioxol-5-yl}ethyl)-N-methylbenzamide

Catalog ID
STL515396
SMILES COc1c(/C=C\2/C(=NC(=O)N(C2=O)CCc2ccc(cc2)F)O)c(CCN(C(=O)c2ccccc2)C)cc2c1OCO2

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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 C31H28FN3O7 MW 573.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28FN3O7/c1-34(29(37)20-6-4-3-5-7-20)14-13-21-16-25-27(42-18-41-25)26(40-2)23(21)17-24-28(36)33-31(39)35(30(24)38)15-12-19-8-10-22(32)11-9-19/h3-11,16-17H,12-15,18H2,1-2H3,(H,33,36,39)/b24-17-
InChIKey
WFPXCOGZJHXMJY-ULJHMMPZSA-N
Synonyms
858768-93-1
~(N)(2(6((~(Z))(1(2(4fluorophenyl)ethyl)246trioxo13diazinan5ylidene)methyl)7methoxy13benzodioxol5yl)ethyl)~(N)methylbenzamide
16399775
858768931
InChI=1SC31H28FN3O7c134(29(37)206435720)141321162527(42184125)26(402)23(21)172428(36)3331(39)35(30(24)38)15121981022(32)11919h3111617H121518H212H3(H333639)b2417
MFCD07199747
N(2(6((Z)(1(2(4fluorophenyl)ethyl)4hydroxy26dioxo16dihydropyrimidin5(2H)ylidene)methyl)7methoxy13benzodioxol5yl)ethyl)Nmethylbenzamide
ZINC000070686791
ZINC70686791

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Available files

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