Vitas-M small molecule compound
(5E)-5-[3-chloro-5-methoxy-4-(propan-2-yloxy)benzylidene]-1-(3,5-dimethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK170713
SMILES COc1cc(/C=C/2\C(=O)NC(=O)N(C2=O)c2cc(C)cc(c2)C)cc(c1OC(C)C)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 C23H23ClN2O5 MW 442.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23ClN2O5/c1-12(2)31-20-18(24)10-15(11-19(20)30-5)9-17-21(27)25-23(29)26(22(17)28)16-7-13(3)6-14(4)8-16/h6-12H,1-5H3,(H,25,27,29)/b17-9+InChIKey
IZKLAQOKJMLESP-RQZCQDPDSA-NSynonyms
(5E)5((3CHLORO5METHOXY4PROPAN2YLOXYPHENYL)METHYLIDENE)1(35DIMETHYLPHENYL)13DIAZINANE246TRIONE
(5E)5(3CHLORO5METHOXY4(PROPAN2YLOXY)BENZYLIDENE)1(35DIMETHYLPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
CC1=CC(=CC(=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)Cl)OC(C)C)OC)C(=O)NC2=O)C
COc1cc(C=C2C(=O)NC(=O)N(C2=O)c2cc(C)cc(c2)C)cc(c1OC(C)C)Cl
InChI=1SC23H23ClN2O5c112(2)312018(24)1015(1119(20)305)91721(27)2523(29)26(22(17)28)16713(3)614(4)816h612H15H3(H252729)b179+
MFCD03059957
ZINC000001155184
ZINC01155184
ZINC1155184
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