Vitas-M small molecule compound
4-(5-{(E)-[3-(2-ethoxy-2-oxoethyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)-3-methylbenzoic acid
Catalog ID
STK089980
SMILES CCOC(=O)CN1C(=O)S/C(=C/c2ccc(o2)c2ccc(cc2C)C(=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 C20H17NO7S MW 415.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17NO7S/c1-3-27-17(22)10-21-18(23)16(29-20(21)26)9-13-5-7-15(28-13)14-6-4-12(19(24)25)8-11(14)2/h4-9H,3,10H2,1-2H3,(H,24,25)/b16-9+InChIKey
GOZGIDCOOCPNFX-CXUHLZMHSA-NSynonyms
4(5((E)(3(2ETHOXY2OXOETHYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)FURAN2YL)3METHYLBENZOICACID
CCOC(=O)CN1C(=O)C(=CC2=CC=C(O2)C3=C(C=C(C=C3)C(=O)O)C)SC1=O
CCOC(=O)CN1C(=O)SC(=Cc2ccc(o2)c2ccc(cc2C)C(=O)O)C1=O
InChI=1SC20H17NO7Sc132717(22)102118(23)16(2920(21)26)9135715(2813)146412(19(24)25)811(14)2h49H310H212H3(H2425)b169+
MFCD03143043
STK089980
ZINC000004673408
ZINC4673408
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