Vitas-M small molecule compound
(5Z)-5-[3-bromo-5-methoxy-4-(naphthalen-1-ylmethoxy)benzylidene]-1-(4-chlorophenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK325838
SMILES COc1cc(/C=C\2/C(=O)NC(=O)N(C2=O)c2ccc(cc2)Cl)cc(c1OCc1cccc2c1cccc2)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 C29H20BrClN2O5 MW 591.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H20BrClN2O5/c1-37-25-15-17(13-23-27(34)32-29(36)33(28(23)35)21-11-9-20(31)10-12-21)14-24(30)26(25)38-16-19-7-4-6-18-5-2-3-8-22(18)19/h2-15H,16H2,1H3,(H,32,34,36)/b23-13-InChIKey
OIRQRKQMICUXCM-QRVIBDJDSA-NSynonyms
(5Z)5((3bromo5methoxy4(naphthalen1ylmethoxy)phenyl)methylidene)1(4chlorophenyl)13diazinane246trione
(5Z)5(3BROMO5METHOXY4(NAPHTHALEN1YLMETHOXY)BENZYLIDENE)1(4CHLOROPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
COC1=C(C(=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)Cl)Br)OCC4=CC=CC5=CC=CC=C54
COc1cc(C=C2C(=O)NC(=O)N(C2=O)c2ccc(cc2)Cl)cc(c1OCc1cccc2c1cccc2)Br
InChI=1SC29H20BrClN2O5c137251517(132327(34)3229(36)33(28(23)35)2111920(31)101221)1424(30)26(25)38161974618523822(18)19h215H16H21H3(H323436)b2313
MFCD01610427
ZINC000100192776
ZINC100192776
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