Vitas-M small molecule compound
(2-ethoxy-4-{(Z)-[4-(ethoxycarbonyl)-5-[(4-methylphenyl)amino]-3-oxothiophen-2(3H)-ylidene]methyl}phenoxy)acetic acid
Catalog ID
STL374712
SMILES CCOC(=O)C1=C(Nc2ccc(cc2)C)S/C(=C\c2ccc(c(c2)OCC)OCC(=O)O)/C1=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 C25H25NO7S MW 483.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25NO7S/c1-4-31-19-12-16(8-11-18(19)33-14-21(27)28)13-20-23(29)22(25(30)32-5-2)24(34-20)26-17-9-6-15(3)7-10-17/h6-13,26H,4-5,14H2,1-3H3,(H,27,28)/b20-13-InChIKey
VSKGKASIIBHNHE-MOSHPQCFSA-NSynonyms
(2ethoxy4((Z)(4(ethoxycarbonyl)5((4methylphenyl)amino)3oxothiophen2(3H)ylidene)methyl)phenoxy)aceticacid2(2ethoxy4((Z)(4ethoxycarbonyl5(4methylanilino)3oxothiophen2ylidene)methyl)phenoxy)aceticacid
CCOC(=O)C1=C(Nc2ccc(cc2)C)SC(=Cc2ccc(c(c2)OCC)OCC(=O)O)C1=O
CCOC1=C(C=CC(=C1)C=C2C(=O)C(=C(S2)NC3=CC=C(C=C3)C)C(=O)OCC)OCC(=O)O
Registry IDs
MFCD02637367ZINC000002971745
ZINC2971745
Check stock
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Check stock on Vitas-MAvailable files
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