Vitas-M small molecule compound
3-(5-{(E)-[3-(2-ethoxy-2-oxoethyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)-2-methylbenzoic acid
Catalog ID
STK074069
SMILES Cc1c(cccc1C(=O)O)c1ccc(o1)/C=C\1/SC(=O)N(C1=O)CC(=O)OCC
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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)9-12-7-8-15(28-12)13-5-4-6-14(11(13)2)19(24)25/h4-9H,3,10H2,1-2H3,(H,24,25)/b16-9+InChIKey
WAHMXQPZUFFUBT-CXUHLZMHSA-NSynonyms
(Z)3(5((3(2ethoxy2oxoethyl)24dioxothiazolidin5ylidene)methyl)furan2yl)2methylbenzoicacid
3(5((E)(3(2ETHOXY2OXOETHYL)24DIOXO13THIAZOLIDIN5YLIDENE)METHYL)FURAN2YL)2METHYLBENZOICACID
Cc1c(cccc1C(=O)O)c1ccc(o1)C=C1SC(=O)N(C1=O)CC(=O)OCC
CCOC(=O)CN1C(=O)C(=CC2=CC=C(O2)C3=C(C(=CC=C3)C(=O)O)C)SC1=O
InChI=1SC20H17NO7Sc132717(22)102118(23)16(2920(21)26)9127815(2812)1354614(11(13)2)19(24)25h49H310H212H3(H2425)b169+
MFCD03727801
STK074069
ZINC000004600073
ZINC4600073
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