Vitas-M small molecule compound
(4E)-4-[3-bromo-5-methoxy-4-(3-phenoxypropoxy)benzylidene]-1-phenylpyrazolidine-3,5-dione
Catalog ID
STK000081
SMILES COc1cc(/C=C/2\C(=O)NN(C2=O)c2ccccc2)cc(c1OCCCOc1ccccc1)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 C26H23BrN2O5 MW 523.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23BrN2O5/c1-32-23-17-18(15-21-25(30)28-29(26(21)31)19-9-4-2-5-10-19)16-22(27)24(23)34-14-8-13-33-20-11-6-3-7-12-20/h2-7,9-12,15-17H,8,13-14H2,1H3,(H,28,30)/b21-15+InChIKey
DSNFOOUPLWMXDG-RCCKNPSSSA-NSynonyms
(4E)4((3BROMO5METHOXY4(3PHENOXYPROPOXY)PHENYL)METHYLIDENE)1PHENYLPYRAZOLIDINE35DIONE
(4E)4(3BROMO5METHOXY4(3PHENOXYPROPOXY)BENZYLIDENE)1PHENYLPYRAZOLIDINE35DIONE
4(3BROMO5METHOXY4(3PHENOXYPROPOXY)BENZYLIDENE)1PHENYL35PYRAZOLIDINEDIONE
COC1=C(C(=CC(=C1)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)Br)OCCCOC4=CC=CC=C4
COc1cc(C=C2C(=O)NN(C2=O)c2ccccc2)cc(c1OCCCOc1ccccc1)Br
InChI=1SC26H23BrN2O5c132231718(152125(30)2829(26(21)31)1994251019)1622(27)24(23)34148133320116371220h279121517H81314H21H3(H2830)b2115+
MFCD03083736
STK000081
ZINC000008453122
ZINC08453122
ZINC8453122
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