Vitas-M small molecule compound
N-[4-({(E)-[4-hydroxy-1-(4-methoxybenzyl)-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}amino)phenyl]acetamide
Catalog ID
STK602673
SMILES COc1ccc(cc1)CN1C(=O)N=C(/C(=C\Nc2ccc(cc2)NC(=O)C)/C1=O)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 C21H20N4O5 MW 408.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O5/c1-13(26)23-16-7-5-15(6-8-16)22-11-18-19(27)24-21(29)25(20(18)28)12-14-3-9-17(30-2)10-4-14/h3-11,22H,12H2,1-2H3,(H,23,26)(H,24,27,29)/b18-11+InChIKey
CPAGMLYOCYWFRW-WOJGMQOQSA-NSynonyms
CC(=O)NC1=CC=C(C=C1)NC=C2C(=O)NC(=O)N(C2=O)CC3=CC=C(C=C3)OC
COc1ccc(cc1)CN1C(=O)N=C(C(=CNc2ccc(cc2)NC(=O)C)C1=O)O
InChI=1SC21H20N4O5c113(26)23167515(6816)22111819(27)2421(29)25(20(18)28)12143917(302)10414h31122H12H212H3(H2326)(H242729)b1811+
MFCD07797587
N(4(((E)(1((4METHOXYPHENYL)METHYL)246TRIOXO13DIAZINAN5YLIDENE)METHYL)AMINO)PHENYL)ACETAMIDE
N(4(((E)(4hydroxy1(4methoxybenzyl)26dioxo16dihydropyrimidin5(2H)ylidene)methyl)amino)phenyl)acetamide
ZINC08997124
ZINC8997124
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