Vitas-M small molecule compound
propyl 2-chloro-5-{5-[(E)-(5-cyano-1,4-dimethyl-2,6-dioxo-1,6-dihydropyridin-3(2H)-ylidene)methyl]furan-2-yl}benzoate
Catalog ID
STK393749
SMILES CCCOC(=O)c1cc(ccc1Cl)c1ccc(o1)/C=C\1/C(=O)N(C)C(=O)C(=C1C)C#N
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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 C23H19ClN2O5 MW 438.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19ClN2O5/c1-4-9-30-23(29)17-10-14(5-7-19(17)24)20-8-6-15(31-20)11-16-13(2)18(12-25)22(28)26(3)21(16)27/h5-8,10-11H,4,9H2,1-3H3/b16-11+InChIKey
OSKOAUMNVOZBGK-LFIBNONCSA-NSynonyms
2CHLORO5(5((E)(5CYANO14DIMETHYL26DIOXO3PYRIDINYLIDENE)METHYL)2FURANYL)BENZOICACIDPROPYLESTER
2CHLORO5(5((E)(5CYANO26DIKETO14DIMETHYL3PYRIDYLIDENE)METHYL)2FURYL)BENZOICACIDPROPYLESTER
CCCOC(=O)C1=C(C=CC(=C1)C2=CC=C(O2)C=C3C(=C(C(=O)N(C3=O)C)C#N)C)Cl
CCCOC(=O)c1cc(ccc1Cl)c1ccc(o1)C=C1C(=O)N(C)C(=O)C(=C1C)C#N
InChI=1SC23H19ClN2O5c1493023(29)171014(5719(17)24)208615(3120)111613(2)18(1225)22(28)26(3)21(16)27h581011H49H213H3b1611+
MFCD03036956
PROPYL2CHLORANYL5(5((E)(5CYANO14DIMETHYL26BIS(OXIDANYLIDENE)PYRIDIN3YLIDENE)METHYL)FURAN2YL)BENZOATE
PROPYL2CHLORO5(5((5CYANO14DIMETHYL26DIOXO(3HYDROPYRIDYLIDENE))METHYL)(2FURYL))BENZOATE
PROPYL2CHLORO5(5((5CYANO14DIMETHYL26DIOXO16DIHYDRO3(2H)PYRIDINYLIDENE)METHYL)2FURYL)BENZOATE
propyl2chloro5(5((E)(5cyano14dimethyl26dioxo16dihydropyridin3(2H)ylidene)methyl)furan2yl)benzoate
PROPYL2CHLORO5(5((E)(5CYANO14DIMETHYL26DIOXOPYRIDIN3YLIDENE)METHYL)FURAN2YL)BENZOATE
ZINC000028616194
ZINC28616194
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