Vitas-M small molecule compound
(4Z)-4-{4-[(3-bromobenzyl)oxy]-3-iodo-5-methoxybenzylidene}-2-(2-chloro-4-nitrophenyl)-1,3-oxazol-5(4H)-one
Catalog ID
STK957844
SMILES COc1cc(/C=C/2\N=C(OC2=O)c2ccc(cc2Cl)[N+](=O)[O-])cc(c1OCc1cccc(c1)Br)I
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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 C24H15BrClIN2O6 MW 669.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H15BrClIN2O6/c1-33-21-10-14(8-19(27)22(21)34-12-13-3-2-4-15(25)7-13)9-20-24(30)35-23(28-20)17-6-5-16(29(31)32)11-18(17)26/h2-11H,12H2,1H3/b20-9-InChIKey
CZAZGQQOUBKIMM-UKWGHVSLSA-NSynonyms
(4Z)4((4((3bromophenyl)methoxy)3iodo5methoxyphenyl)methylidene)2(2chloro4nitrophenyl)13oxazol5one
(4Z)4(4((3bromobenzyl)oxy)3iodo5methoxybenzylidene)2(2chloro4nitrophenyl)13oxazol5(4H)one
COC1=C(C(=CC(=C1)C=C2C(=O)OC(=N2)C3=C(C=C(C=C3)(N+)(=O)(O))Cl)I)OCC4=CC(=CC=C4)Br
COc1cc(C=C2N=C(OC2=O)c2ccc(cc2Cl)(N+)(=O)(O))cc(c1OCc1cccc(c1)Br)I
InChI=1SC24H15BrClIN2O6c133211014(819(27)22(21)34121332415(25)713)92024(30)3523(2820)176516(29(31)32)1118(17)26h211H12H21H3b209
MFCD01919926
ZINC000150395459
ZINC150395459
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