Vitas-M small molecule compound
(5Z)-1-(4-chlorophenyl)-5-{3-ethoxy-4-[3-(3-methylphenoxy)propoxy]benzylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK037656
SMILES CCOc1cc(ccc1OCCCOc1cccc(c1)C)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)Cl
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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 C29H27ClN2O6 MW 535.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27ClN2O6/c1-3-36-26-18-20(8-13-25(26)38-15-5-14-37-23-7-4-6-19(2)16-23)17-24-27(33)31-29(35)32(28(24)34)22-11-9-21(30)10-12-22/h4,6-13,16-18H,3,5,14-15H2,1-2H3,(H,31,33,35)/b24-17-InChIKey
PZLGBTCPBWHVHX-ULJHMMPZSA-NSynonyms
(5Z)1(4chlorophenyl)5((3ethoxy4(3(3methylphenoxy)propoxy)phenyl)methylidene)13diazinane246trione
(5Z)1(4CHLOROPHENYL)5(3ETHOXY4(3(3METHYLPHENOXY)PROPOXY)BENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
CCOC1=C(C=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)Cl)OCCCOC4=CC=CC(=C4)C
CCOc1cc(ccc1OCCCOc1cccc(c1)C)C=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)Cl
InChI=1SC29H27ClN2O6c1336261820(81325(26)3815514372374619(2)1623)172427(33)3129(35)32(28(24)34)2211921(30)101222h46131618H351415H212H3(H313335)b2417
MFCD05975978
STK037656
ZINC000097958506
ZINC97958506
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