Vitas-M small molecule compound
{2-bromo-4-[(E)-{2-[(4-ethylphenyl)amino]-4-oxo-1,3-thiazol-5(4H)-ylidene}methyl]-6-methoxyphenoxy}acetic acid
Catalog ID
STL491752
SMILES CCc1ccc(cc1)NC1=NC(=O)/C(=C\c2cc(Br)c(c(c2)OC)OCC(=O)O)/S1
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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 C21H19BrN2O5S MW 491.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19BrN2O5S/c1-3-12-4-6-14(7-5-12)23-21-24-20(27)17(30-21)10-13-8-15(22)19(16(9-13)28-2)29-11-18(25)26/h4-10H,3,11H2,1-2H3,(H,25,26)(H,23,24,27)/b17-10+InChIKey
ILBKHLJIVOZMET-LICLKQGHSA-NSynonyms
(2BROMO4((E)((2Z)2((4ETHYLPHENYL)IMINO)4OXO13THIAZOLIDIN5YLIDENE)METHYL)6METHOXYPHENOXY)ACETICACID
(2bromo4((E)(2((4ethylphenyl)amino)4oxo13thiazol5(4H)ylidene)methyl)6methoxyphenoxy)aceticacid
2(2BROMO4((E)(2(4ETHYLANILINO)4OXO13THIAZOL5YLIDENE)METHYL)6METHOXYPHENOXY)ACETICACID
CCC1=CC=C(C=C1)NC2=NC(=O)C(=CC3=CC(=C(C(=C3)Br)OCC(=O)O)OC)S2
CCc1ccc(cc1)NC1=NC(=O)C(=Cc2cc(Br)c(c(c2)OC)OCC(=O)O)S1
InChI=1SC21H19BrN2O5Sc13124614(7512)23212420(27)17(3021)1013815(22)19(16(913)282)291118(25)26h410H311H212H3(H2526)(H232427)b1710+
MFCD30714709
ZINC000009311317
ZINC9311317
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