Vitas-M small molecule compound

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

Catalog ID
STK580518
SMILES COc1ccc(cc1COc1ccc(cc1)NC(=O)C)/C=C/1\C(=NC(=O)N(C1=O)c1ccc(cc1)C(C)C)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 C30H29N3O6 MW 527.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N3O6/c1-18(2)21-6-10-24(11-7-21)33-29(36)26(28(35)32-30(33)37)16-20-5-14-27(38-4)22(15-20)17-39-25-12-8-23(9-13-25)31-19(3)34/h5-16,18H,17H2,1-4H3,(H,31,34)(H,32,35,37)/b26-16+
InChIKey
YLGAHUGFPWHMJL-WGOQTCKBSA-N
Synonyms

CC(C)C1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3)OC)COC4=CC=C(C=C4)NC(=O)C)C(=O)NC2=O
COc1ccc(cc1COc1ccc(cc1)NC(=O)C)C=C1C(=NC(=O)N(C1=O)c1ccc(cc1)C(C)C)O
InChI=1SC30H29N3O6c118(2)2161024(11721)3329(36)26(28(35)3230(33)37)162051427(384)22(1520)17392512823(91325)3119(3)34h51618H17H214H3(H3134)(H323537)b2616+
MFCD07200909
N(4((2METHOXY5((E)(246TRIOXO1(4PROPAN2YLPHENYL)13DIAZINAN5YLIDENE)METHYL)PHENYL)METHOXY)PHENYL)ACETAMIDE
N(4((5((E)(4hydroxy26dioxo1(4(propan2yl)phenyl)16dihydropyrimidin5(2H)ylidene)methyl)2methoxybenzyl)oxy)phenyl)acetamide
ZINC000016973666
ZINC16973666

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Available files

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