Vitas-M small molecule compound
(2E)-3-(3,5-dichloro-2-methoxyphenyl)-N-[3-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]prop-2-enamide
Catalog ID
STK248583
SMILES COc1c(/C=C/C(=O)Nc2cccc(c2)c2oc3c(n2)cc(c(c3)C)C)cc(cc1Cl)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 C25H20Cl2N2O3 MW 467.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20Cl2N2O3/c1-14-9-21-22(10-15(14)2)32-25(29-21)17-5-4-6-19(12-17)28-23(30)8-7-16-11-18(26)13-20(27)24(16)31-3/h4-13H,1-3H3,(H,28,30)/b8-7+InChIKey
KGYZHGREHVFKBP-BQYQJAHWSA-NSynonyms
(2E)3(35dichloro2methoxyphenyl)N(3(56dimethyl13benzoxazol2yl)phenyl)prop2enamide
(E)3(35DICHLORO2METHOXYPHENYL)N(3(56DIMETHYL13BENZOXAZOL2YL)PHENYL)PROP2ENAMIDE
CC1=CC2=C(C=C1C)OC(=N2)C3=CC(=CC=C3)NC(=O)C=CC4=CC(=CC(=C4OC)Cl)Cl
COc1c(C=CC(=O)Nc2cccc(c2)c2oc3c(n2)cc(c(c3)C)C)cc(cc1Cl)Cl
InChI=1SC25H20Cl2N2O3c11492122(1015(14)2)3225(2921)1754619(1217)2823(30)87161118(26)1320(27)24(16)313h413H13H3(H2830)b87+
MFCD04074817
ZINC000002593091
ZINC02593091
ZINC2593091
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