Vitas-M small molecule compound
2-chloro-4-(5-{(E)-[3-(2-methoxy-2-oxoethyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoic acid
Catalog ID
STK984291
SMILES COC(=O)CN1C(=O)S/C(=C/c2ccc(o2)c2ccc(c(c2)Cl)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 C18H12ClNO7S MW 421.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12ClNO7S/c1-26-15(21)8-20-16(22)14(28-18(20)25)7-10-3-5-13(27-10)9-2-4-11(17(23)24)12(19)6-9/h2-7H,8H2,1H3,(H,23,24)/b14-7+InChIKey
VAAQXLRYAFXQPR-VGOFMYFVSA-NSynonyms
593272-19-6(E)2chloro4(5((3(2methoxy2oxoethyl)24dioxothiazolidin5ylidene)methyl)furan2yl)benzoicacid
2chloro4(5((E)(3(2methoxy2oxoethyl)24dioxo13thiazolidin5ylidene)methyl)furan2yl)benzoicacid
593272196
COC(=O)CN1C(=O)C(=CC2=CC=C(O2)C3=CC(=C(C=C3)C(=O)O)Cl)SC1=O
COC(=O)CN1C(=O)SC(=Cc2ccc(o2)c2ccc(c(c2)Cl)C(=O)O)C1=O
InChI=1SC18H12ClNO7Sc12615(21)82016(22)14(2818(20)25)7103513(2710)92411(17(23)24)12(19)69h27H8H21H3(H2324)b147+
MFCD03923180
ZINC000009454508
ZINC9454508
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