Vitas-M small molecule compound
(5Z)-1-(4-bromophenyl)-5-{3-methoxy-4-[3-(3-methylphenoxy)propoxy]benzylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK041227
SMILES COc1cc(ccc1OCCCOc1cccc(c1)C)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)Br
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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 C28H25BrN2O6 MW 565.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25BrN2O6/c1-18-5-3-6-22(15-18)36-13-4-14-37-24-12-7-19(17-25(24)35-2)16-23-26(32)30-28(34)31(27(23)33)21-10-8-20(29)9-11-21/h3,5-12,15-17H,4,13-14H2,1-2H3,(H,30,32,34)/b23-16-InChIKey
ZZRXJERWLOIHOK-KQWNVCNZSA-NSynonyms
(5Z)1(4bromophenyl)5((3methoxy4(3(3methylphenoxy)propoxy)phenyl)methylidene)13diazinane246trione
(5Z)1(4BROMOPHENYL)5(3METHOXY4(3(3METHYLPHENOXY)PROPOXY)BENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
CC1=CC(=CC=C1)OCCCOC2=C(C=C(C=C2)C=C3C(=O)NC(=O)N(C3=O)C4=CC=C(C=C4)Br)OC
COc1cc(ccc1OCCCOc1cccc(c1)C)C=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)Br
InChI=1SC28H25BrN2O6c11853622(1518)3613414372412719(1725(24)352)162326(32)3028(34)31(27(23)33)2110820(29)91121h35121517H41314H212H3(H303234)b2316
MFCD05976097
STK041227
ZINC000097958544
ZINC97958544
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