Vitas-M small molecule compound
(4E)-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylidene]-1-[3-(1H-imidazol-1-yl)propyl]-5-[4-(propan-2-yl)phenyl]pyrrolidine-2,3-dione
Catalog ID
STK618404
SMILES O=C1C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/O)/C(N1CCCn1cncc1)c1ccc(cc1)C(C)C
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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 C28H29N3O5 MW 487.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N3O5/c1-18(2)19-4-6-20(7-5-19)25-24(26(32)21-8-9-22-23(16-21)36-15-14-35-22)27(33)28(34)31(25)12-3-11-30-13-10-29-17-30/h4-10,13,16-18,25,32H,3,11-12,14-15H2,1-2H3/b26-24+InChIKey
ZEUZOVATSPSBNL-SHHOIMCASA-NSynonyms
618410-13-2(4E)4(23dihydro14benzodioxin6yl(hydroxy)methylidene)1(3(1Himidazol1yl)propyl)5(4(propan2yl)phenyl)pyrrolidine23dione
(4E)4(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)1(3IMIDAZOL1YLPROPYL)5(4PROPAN2YLPHENYL)PYRROLIDINE23DIONE
CC(C)C1=CC=C(C=C1)C2C(=C(C3=CC4=C(C=C3)OCCO4)O)C(=O)C(=O)N2CCCN5C=CN=C5
InChI=1SC28H29N3O5c118(2)194620(7519)2524(26(32)21892223(1621)3615143522)27(33)28(34)31(25)12311301310291730h4101316182532H311121415H212H3b2624+
MFCD09798563
O=C1C(=O)C(=C(c2ccc3c(c2)OCCO3)O)C(N1CCCn1cncc1)c1ccc(cc1)C(C)C
ZINC000102717323
ZINC000102717326
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