Vitas-M small molecule compound

2-chloro-5-({(2E,5E)-5-[3-ethoxy-4-(naphthalen-1-ylmethoxy)benzylidene]-4-oxo-1,3-thiazolidin-2-ylidene}amino)benzoic acid

Catalog ID
STK675910
SMILES CCOc1cc(ccc1OCc1cccc2c1cccc2)/C=C\1/S/C(=N/c2ccc(c(c2)C(=O)O)Cl)/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 C30H23ClN2O5S MW 559.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H23ClN2O5S/c1-2-37-26-14-18(10-13-25(26)38-17-20-8-5-7-19-6-3-4-9-22(19)20)15-27-28(34)33-30(39-27)32-21-11-12-24(31)23(16-21)29(35)36/h3-16H,2,17H2,1H3,(H,35,36)(H,32,33,34)/b27-15+
InChIKey
BAPFJNJFLHTFAF-JFLMPSFJSA-N
Synonyms

2CHLORO5(((2E5E)5(3ETHOXY4(NAPHTHALEN1YLMETHOXY)BENZYLIDENE)4OXO13THIAZOLIDIN2YLIDENE)AMINO)BENZOICACID
2CHLORO5(((5E)5((3ETHOXY4(NAPHTHALEN1YLMETHOXY)PHENYL)METHYLIDENE)4OXO13THIAZOL2YL)AMINO)BENZOICACID
CCOC1=C(C=CC(=C1)C=C2C(=O)N=C(S2)NC3=CC(=C(C=C3)Cl)C(=O)O)OCC4=CC=CC5=CC=CC=C54
CCOc1cc(ccc1OCc1cccc2c1cccc2)C=C1SC(=Nc2ccc(c(c2)C(=O)O)Cl)NC1=O
InChI=1SC30H23ClN2O5Sc1237261418(101325(26)38172085719634922(19)20)152728(34)3330(3927)3221111224(31)23(1621)29(35)36h316H217H21H3(H3536)(H323334)b2715+
MFCD01820990
ZINC000100083786
ZINC100083786

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Available files

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