Vitas-M small molecule compound
(5E)-4-[(3,5-dimethoxyphenyl)amino]-5-[(2-hydroxy-6-methoxyquinolin-3-yl)methylidene]-1,3-thiazol-2(5H)-one
Catalog ID
STL248657
SMILES COc1cc(OC)cc(c1)NC1=NC(=O)S/C/1=C/c1cc2cc(OC)ccc2nc1O
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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 C22H19N3O5S MW 437.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O5S/c1-28-15-4-5-18-12(7-15)6-13(21(26)24-18)8-19-20(25-22(27)31-19)23-14-9-16(29-2)11-17(10-14)30-3/h4-11H,1-3H3,(H,24,26)(H,23,25,27)/b19-8+InChIKey
OONKSDWQILBPDV-UFWORHAWSA-NSynonyms
(5E)4((35dimethoxyphenyl)amino)5((2hydroxy6methoxyquinolin3yl)methylidene)13thiazol2(5H)one
(5E)4(35dimethoxyanilino)5((6methoxy2oxo1Hquinolin3yl)methylidene)13thiazol2one
COC1=CC2=C(C=C1)NC(=O)C(=C2)C=C3C(=NC(=O)S3)NC4=CC(=CC(=C4)OC)OC
COc1cc(OC)cc(c1)NC1=NC(=O)SC1=Cc1cc2cc(OC)ccc2nc1O
InChI=1SC22H19N3O5Sc12815451812(715)613(21(26)2418)81920(2522(27)3119)2314916(292)1117(1014)303h411H13H3(H2426)(H232527)b198+
MFCD24861268
ZINC000080332310
ZINC80332310
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