Vitas-M small molecule compound
2-chloro-4-(5-{(E)-[1-(4-ethoxyphenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}furan-2-yl)benzoic acid
Catalog ID
STK189391
SMILES CCOc1ccc(cc1)N1C(=S)NC(=O)/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 C24H17ClN2O6S MW 496.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17ClN2O6S/c1-2-32-15-6-4-14(5-7-15)27-22(29)18(21(28)26-24(27)34)12-16-8-10-20(33-16)13-3-9-17(23(30)31)19(25)11-13/h3-12H,2H2,1H3,(H,30,31)(H,26,28,34)/b18-12+InChIKey
GMURYYUMLUVQGT-LDADJPATSA-NSynonyms
2CHLORO4(5((E)(1(4ETHOXYPHENYL)46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)FURAN2YL)BENZOICACID
2CHLORO4(5((E)(1(4ETHOXYPHENYL)46DIOXO2THIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)FURAN2YL)BENZOICACID
CCOC1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(O3)C4=CC(=C(C=C4)C(=O)O)Cl)C(=O)NC2=S
CCOc1ccc(cc1)N1C(=S)NC(=O)C(=Cc2ccc(o2)c2ccc(c(c2)Cl)C(=O)O)C1=O
InChI=1SC24H17ClN2O6Sc1232156414(5715)2722(29)18(21(28)2624(27)34)121681020(3316)133917(23(30)31)19(25)1113h312H2H21H3(H3031)(H262834)b1812+
MFCD02211752
ZINC000002873462
ZINC2873462
Check stock
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