Vitas-M small molecule compound

N-{4-[(5-{(E)-[1-(4-fluorobenzyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}-2-methoxybenzyl)oxy]phenyl}acetamide

Catalog ID
STL043073
SMILES COc1ccc(cc1COc1ccc(cc1)NC(=O)C)/C=C/1\C(=NC(=O)N(C1=O)Cc1ccc(cc1)F)O

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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 C28H24FN3O6 MW 517.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24FN3O6/c1-17(33)30-22-8-10-23(11-9-22)38-16-20-13-19(5-12-25(20)37-2)14-24-26(34)31-28(36)32(27(24)35)15-18-3-6-21(29)7-4-18/h3-14H,15-16H2,1-2H3,(H,30,33)(H,31,34,36)/b24-14+
InChIKey
GOQYSVQBOVBHAS-ZVHZXABRSA-N
Synonyms

CC(=O)NC1=CC=C(C=C1)OCC2=C(C=CC(=C2)C=C3C(=O)NC(=O)N(C3=O)CC4=CC=C(C=C4)F)OC
COc1ccc(cc1COc1ccc(cc1)NC(=O)C)C=C1C(=NC(=O)N(C1=O)Cc1ccc(cc1)F)O
InChI=1SC28H24FN3O6c117(33)302281023(11922)3816201319(51225(20)372)142426(34)3128(36)32(27(24)35)15183621(29)7418h314H1516H212H3(H3033)(H313436)b2414+
MFCD08732052
N(4((5((E)(1((4FLUOROPHENYL)METHYL)246TRIOXO13DIAZINAN5YLIDENE)METHYL)2METHOXYPHENYL)METHOXY)PHENYL)ACETAMIDE
N(4((5((E)(1(4FLUOROBENZYL)4HYDROXY26DIOXO16DIHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)2METHOXYBENZYL)OXY)PHENYL)ACETAMIDE
ZINC000008914577
ZINC08914577
ZINC8914577

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Available files

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