Vitas-M small molecule compound

2-{4-[(Z)-{(2Z)-2-[(5-chloro-2-methylphenyl)imino]-4-oxo-1,3-thiazolidin-5-ylidene}methyl]-2-methoxyphenoxy}propanoic acid

Catalog ID
STK157883
SMILES COc1cc(ccc1OC(C(=O)O)C)/C=C/1\S/C(=N\c2cc(Cl)ccc2C)/NC1=O

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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 C21H19ClN2O5S MW 446.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClN2O5S/c1-11-4-6-14(22)10-15(11)23-21-24-19(25)18(30-21)9-13-5-7-16(17(8-13)28-3)29-12(2)20(26)27/h4-10,12H,1-3H3,(H,26,27)(H,23,24,25)/b18-9-
InChIKey
HTROECLAAXEVIF-NVMNQCDNSA-N
Synonyms

2(4((2((5CHLORO2METHYLPHENYL)IMINO)4OXO13THIAZOLIDIN5YLIDENE)METHYL)2METHOXYPHENOXY)PROPANOICACID
2(4((Z)((2Z)2((5CHLORO2METHYLPHENYL)IMINO)4OXO13THIAZOLIDIN5YLIDENE)METHYL)2METHOXYPHENOXY)PROPANOICACID
2(4((Z)(2(5chloro2methylanilino)4oxo13thiazol5ylidene)methyl)2methoxyphenoxy)propanoicacid
CC1=C(C=C(C=C1)Cl)NC2=NC(=O)C(=CC3=CC(=C(C=C3)OC(C)C(=O)O)OC)S2
COc1cc(ccc1OC(C(=O)O)C)C=C1SC(=Nc2cc(Cl)ccc2C)NC1=O
InChI=1SC21H19ClN2O5Sc1114614(22)1015(11)23212419(25)18(3021)9135716(17(813)283)2912(2)20(26)27h41012H13H3(H2627)(H232425)b189
MFCD03696878
ZINC000008396028
ZINC000033348429

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Available files

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