Vitas-M small molecule compound
(5Z)-5-{3-chloro-4-[(2-fluorobenzyl)oxy]-5-methoxybenzylidene}-1-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STL484679
SMILES COc1cc(cc(c1OCc1ccccc1F)Cl)/C=C\1/C(=O)NC(=S)N(C1=O)c1ccccc1
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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 C25H18ClFN2O4S MW 496.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18ClFN2O4S/c1-32-21-13-15(12-19(26)22(21)33-14-16-7-5-6-10-20(16)27)11-18-23(30)28-25(34)29(24(18)31)17-8-3-2-4-9-17/h2-13H,14H2,1H3,(H,28,30,34)/b18-11-InChIKey
LACCXZXZCISONE-WQRHYEAKSA-NSynonyms
(5Z)5((3CHLORO4((2FLUOROPHENYL)METHOXY)5METHOXYPHENYL)METHYLIDENE)1PHENYL2SULFANYLIDENE13DIAZINANE46DIONE
(5Z)5(3chloro4((2fluorobenzyl)oxy)5methoxybenzylidene)1phenyl2thioxodihydropyrimidine46(1H5H)dione
5(3CHLORO4((2FLUOROBENZYL)OXY)5METHOXYBENZYLIDENE)1PHENYL2THIOXODIHYDRO46(1H5H)PYRIMIDINEDIONE
COC1=C(C(=CC(=C1)C=C2C(=O)NC(=S)N(C2=O)C3=CC=CC=C3)Cl)OCC4=CC=CC=C4F
COc1cc(cc(c1OCc1ccccc1F)Cl)C=C1C(=O)NC(=S)N(C1=O)c1ccccc1
InChI=1SC25H18ClFN2O4Sc132211315(1219(26)22(21)3314167561020(16)27)111823(30)2825(34)29(24(18)31)178324917h213H14H21H3(H283034)b1811
MFCD03269225
ZINC000000657484
ZINC00657484
ZINC657484
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