Vitas-M small molecule compound
(4E)-4-{3-chloro-5-methoxy-4-[3-(4-methylphenoxy)propoxy]benzylidene}-1-phenylpyrazolidine-3,5-dione
Catalog ID
STK057380
SMILES COc1cc(/C=C/2\C(=O)NN(C2=O)c2ccccc2)cc(c1OCCCOc1ccc(cc1)C)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 C27H25ClN2O5 MW 492.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25ClN2O5/c1-18-9-11-21(12-10-18)34-13-6-14-35-25-23(28)16-19(17-24(25)33-2)15-22-26(31)29-30(27(22)32)20-7-4-3-5-8-20/h3-5,7-12,15-17H,6,13-14H2,1-2H3,(H,29,31)/b22-15+InChIKey
PRHMTNVMIUOSRT-PXLXIMEGSA-NSynonyms
(4E)4((3CHLORO5METHOXY4(3(4METHYLPHENOXY)PROPOXY)PHENYL)METHYLIDENE)1PHENYLPYRAZOLIDINE35DIONE
(4E)4(3CHLORO5METHOXY4(3(4METHYLPHENOXY)PROPOXY)BENZYLIDENE)1PHENYLPYRAZOLIDINE35DIONE
4(3CHLORO5METHOXY4(3(4METHYLPHENOXY)PROPOXY)BENZYLIDENE)1PHENYL35PYRAZOLIDINEDIONE
CC1=CC=C(C=C1)OCCCOC2=C(C=C(C=C2Cl)C=C3C(=O)NN(C3=O)C4=CC=CC=C4)OC
COc1cc(C=C2C(=O)NN(C2=O)c2ccccc2)cc(c1OCCCOc1ccc(cc1)C)Cl
InChI=1SC27H25ClN2O5c11891121(121018)3413614352523(28)1619(1724(25)332)152226(31)2930(27(22)32)207435820h357121517H61314H212H3(H2931)b2215+
MFCD03228032
STK057380
ZINC000008453146
ZINC08453146
ZINC8453146
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