Vitas-M small molecule compound
(5Z)-5-{4-[(2-chlorobenzyl)oxy]-3-ethoxybenzylidene}-1-phenyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STL484680
SMILES CCOc1cc(ccc1OCc1ccccc1Cl)/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 C26H21ClN2O4S MW 492.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21ClN2O4S/c1-2-32-23-15-17(12-13-22(23)33-16-18-8-6-7-11-21(18)27)14-20-24(30)28-26(34)29(25(20)31)19-9-4-3-5-10-19/h3-15H,2,16H2,1H3,(H,28,30,34)/b20-14-InChIKey
KBGSIWDXPLWQHB-ZHZULCJRSA-NSynonyms
(5Z)5((4((2CHLOROPHENYL)METHOXY)3ETHOXYPHENYL)METHYLIDENE)1PHENYL2SULFANYLIDENE13DIAZINANE46DIONE
(5Z)5(4((2chlorobenzyl)oxy)3ethoxybenzylidene)1phenyl2thioxodihydropyrimidine46(1H5H)dione
CCOC1=C(C=CC(=C1)C=C2C(=O)NC(=S)N(C2=O)C3=CC=CC=C3)OCC4=CC=CC=C4Cl
CCOc1cc(ccc1OCc1ccccc1Cl)C=C1C(=O)NC(=S)N(C1=O)c1ccccc1
InChI=1SC26H21ClN2O4Sc1232231517(121322(23)3316188671121(18)27)142024(30)2826(34)29(25(20)31)1994351019h315H216H21H3(H283034)b2014
MFCD02106299
ZINC000016677423
ZINC16677423
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