Vitas-M small molecule compound
4-chloro-3-(5-{(E)-[1-(2,4-dimethoxyphenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}furan-2-yl)benzoic acid
Catalog ID
STK109190
SMILES COc1ccc(c(c1)OC)N1C(=S)NC(=O)/C(=C\c2ccc(o2)c2cc(ccc2Cl)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 C24H17ClN2O7S MW 512.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17ClN2O7S/c1-32-13-4-7-18(20(11-13)33-2)27-22(29)16(21(28)26-24(27)35)10-14-5-8-19(34-14)15-9-12(23(30)31)3-6-17(15)25/h3-11H,1-2H3,(H,30,31)(H,26,28,35)/b16-10+InChIKey
GKZVYUJPEPDXTB-MHWRWJLKSA-NSynonyms
4CHLORO3(5((E)(1(24DIMETHOXYPHENYL)46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)FURAN2YL)BENZOICACID
4CHLORO3(5((E)(1(24DIMETHOXYPHENYL)46DIOXO2THIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)FURAN2YL)BENZOICACID
COC1=CC(=C(C=C1)N2C(=O)C(=CC3=CC=C(O3)C4=C(C=CC(=C4)C(=O)O)Cl)C(=O)NC2=S)OC
COc1ccc(c(c1)OC)N1C(=S)NC(=O)C(=Cc2ccc(o2)c2cc(ccc2Cl)C(=O)O)C1=O
InChI=1SC24H17ClN2O7Sc132134718(20(1113)332)2722(29)16(21(28)2624(27)35)10145819(3414)15912(23(30)31)3617(15)25h311H12H3(H3031)(H262835)b1610+
MFCD04126576
ZINC000009763121
ZINC9763121
Check stock
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