Vitas-M small molecule compound
(5Z)-5-{4-methoxy-3-[(3-methyl-4-nitrophenoxy)methyl]benzylidene}-2-(phenylamino)-1,3-thiazol-4(5H)-one
Catalog ID
STK409743
SMILES COc1ccc(cc1COc1ccc(c(c1)C)[N+](=O)[O-])/C=C/1\SC(=NC1=O)Nc1ccccc1
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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 C25H21N3O5S MW 475.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N3O5S/c1-16-12-20(9-10-21(16)28(30)31)33-15-18-13-17(8-11-22(18)32-2)14-23-24(29)27-25(34-23)26-19-6-4-3-5-7-19/h3-14H,15H2,1-2H3,(H,26,27,29)/b23-14-InChIKey
GFEONHWOOKTJEL-UCQKPKSFSA-NSynonyms
(5Z)2anilino5((4methoxy3((3methyl4nitrophenoxy)methyl)phenyl)methylidene)13thiazol4one
(5Z)5(4methoxy3((3methyl4nitrophenoxy)methyl)benzylidene)2(phenylamino)13thiazol4(5H)one
CC1=C(C=CC(=C1)OCC2=C(C=CC(=C2)C=C3C(=O)N=C(S3)NC4=CC=CC=C4)OC)(N+)(=O)(O)
COc1ccc(cc1COc1ccc(c(c1)C)(N+)(=O)(O))C=C1SC(=NC1=O)Nc1ccccc1
InChI=1SC25H21N3O5Sc1161220(91021(16)28(30)31)3315181317(81122(18)322)142324(29)2725(3423)26196435719h314H15H212H3(H262729)b2314
MFCD08122565
ZINC000020352815
ZINC20352815
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