Vitas-M small molecule compound

(5E)-4-[(3-chlorophenyl)amino]-5-[(2-hydroxy-6-methoxyquinolin-3-yl)methylidene]-1,3-thiazol-2(5H)-one

Catalog ID
STL249774
SMILES COc1ccc2c(c1)cc(c(n2)O)/C=C\1/SC(=O)N=C1Nc1cccc(c1)Cl

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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 C20H14ClN3O3S MW 411.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14ClN3O3S/c1-27-15-5-6-16-11(8-15)7-12(19(25)23-16)9-17-18(24-20(26)28-17)22-14-4-2-3-13(21)10-14/h2-10H,1H3,(H,23,25)(H,22,24,26)/b17-9+
InChIKey
OJWHVOHPPHOCMU-RQZCQDPDSA-N
Synonyms

(5E)4((3chlorophenyl)amino)5((2hydroxy6methoxyquinolin3yl)methylidene)13thiazol2(5H)one
(5E)4(3chloroanilino)5((6methoxy2oxo1Hquinolin3yl)methylidene)13thiazol2one
COC1=CC2=C(C=C1)NC(=O)C(=C2)C=C3C(=NC(=O)S3)NC4=CC(=CC=C4)Cl
COc1ccc2c(c1)cc(c(n2)O)C=C1SC(=O)N=C1Nc1cccc(c1)Cl
InChI=1SC20H14ClN3O3Sc12715561611(815)712(19(25)2316)91718(2420(26)2817)221442313(21)1014h210H1H3(H2325)(H222426)b179+
MFCD24861638
ZINC000080336945
ZINC80336945

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Available files

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