Vitas-M small molecule compound
ethyl 4-(5-{(E)-[1-(4-chlorophenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}furan-2-yl)benzoate
Catalog ID
STK071942
SMILES CCOC(=O)c1ccc(cc1)c1ccc(o1)/C=C/1\C(=O)NC(=O)N(C1=O)c1ccc(cc1)Cl
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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 C24H17ClN2O6 MW 464.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17ClN2O6/c1-2-32-23(30)15-5-3-14(4-6-15)20-12-11-18(33-20)13-19-21(28)26-24(31)27(22(19)29)17-9-7-16(25)8-10-17/h3-13H,2H2,1H3,(H,26,28,31)/b19-13+InChIKey
SHCAEYXLJLUHPF-CPNJWEJPSA-NSynonyms
(Z)ethyl4(5((1(4chlorophenyl)246trioxotetrahydropyrimidin5(2H)ylidene)methyl)furan2yl)benzoate
CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=C3C(=O)NC(=O)N(C3=O)C4=CC=C(C=C4)Cl
CCOC(=O)c1ccc(cc1)c1ccc(o1)C=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)Cl
ETHYL4(5((E)(1(4CHLOROPHENYL)246TRIOXO13DIAZINAN5YLIDENE)METHYL)FURAN2YL)BENZOATE
ETHYL4(5((E)(1(4CHLOROPHENYL)246TRIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)FURAN2YL)BENZOATE
InChI=1SC24H17ClN2O6c123223(30)155314(4615)20121118(3320)131921(28)2624(31)27(22(19)29)179716(25)81017h313H2H21H3(H262831)b1913+
MFCD01541200
STK071942
ZINC000002306375
ZINC02306375
ZINC2306375
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