Vitas-M small molecule compound
(5E)-6-hydroxy-3-(2-methylphenyl)-5-(1-{[2-(piperidin-1-yl)ethyl]amino}ethylidene)pyrimidine-2,4(3H,5H)-dione
Catalog ID
STK598872
SMILES O=C1N=C(O)/C(=C(\NCCN2CCCCC2)/C)/C(=O)N1c1ccccc1C
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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 C20H26N4O3 MW 370.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N4O3/c1-14-8-4-5-9-16(14)24-19(26)17(18(25)22-20(24)27)15(2)21-10-13-23-11-6-3-7-12-23/h4-5,8-9,21H,3,6-7,10-13H2,1-2H3,(H,22,25,27)/b17-15+InChIKey
WMFLNQNLZBXMSJ-BMRADRMJSA-NSynonyms
(5E)1(2methylphenyl)5(1(2piperidin1ylethylamino)ethylidene)13diazinane246trione
(5E)6hydroxy3(2methylphenyl)5(1((2(piperidin1yl)ethyl)amino)ethylidene)pyrimidine24(3H5H)dione
CC1=CC=CC=C1N2C(=O)C(=C(C)NCCN3CCCCC3)C(=O)NC2=O
InChI=1SC20H26N4O3c114845916(14)2419(26)17(18(25)2220(24)27)15(2)21101323116371223h458921H3671013H212H3(H222527)b1715+
MFCD07206435
O=C1N=C(O)C(=C(NCCN2CCCCC2)C)C(=O)N1c1ccccc1C
ZINC000020331530
ZINC20331530
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