Vitas-M small molecule compound
(4E)-4-{3,5-diiodo-4-[(3-methylbenzyl)oxy]benzylidene}-2-(4-methyl-3-nitrophenyl)-1,3-oxazol-5(4H)-one
Catalog ID
STL170189
SMILES Cc1cccc(c1)COc1c(I)cc(cc1I)/C=C\1/N=C(OC1=O)c1ccc(c(c1)[N+](=O)[O-])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 C25H18I2N2O5 MW 680.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18I2N2O5/c1-14-4-3-5-16(8-14)13-33-23-19(26)9-17(10-20(23)27)11-21-25(30)34-24(28-21)18-7-6-15(2)22(12-18)29(31)32/h3-12H,13H2,1-2H3/b21-11+InChIKey
FCDBMUKXGRAOQF-SRZZPIQSSA-NSynonyms
514218-03-2(4E)4((35DIIODO4((3METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)2(4METHYL3NITROPHENYL)13OXAZOL5ONE
(4E)4(35diiodo4((3methylbenzyl)oxy)benzylidene)2(4methyl3nitrophenyl)13oxazol5(4H)one
514218032
CC1=CC(=CC=C1)COC2=C(C=C(C=C2I)C=C3C(=O)OC(=N3)C4=CC(=C(C=C4)C)(N+)(=O)(O))I
Cc1cccc(c1)COc1c(I)cc(cc1I)C=C1N=C(OC1=O)c1ccc(c(c1)(N+)(=O)(O))C
InChI=1SC25H18I2N2O5c11443516(814)13332319(26)917(1020(23)27)112125(30)3424(2821)187615(2)22(1218)29(31)32h312H13H212H3b2111+
MFCD03784380
ZINC000150428661
ZINC150428661
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