Vitas-M small molecule compound
(6Z)-6-{4-[(3,4-dichlorobenzyl)oxy]-3-ethoxybenzylidene}-5-imino-2-(thiophen-2-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK047897
SMILES CCOc1cc(ccc1OCc1ccc(c(c1)Cl)Cl)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)c1cccs1
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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 C25H18Cl2N4O3S2 MW 557.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18Cl2N4O3S2/c1-2-33-20-12-14(6-8-19(20)34-13-15-5-7-17(26)18(27)11-15)10-16-22(28)31-25(29-23(16)32)36-24(30-31)21-4-3-9-35-21/h3-12,28H,2,13H2,1H3/b16-10-,28-22-InChIKey
YKRYYUDRQJVBJL-CJPWHFHGSA-NSynonyms
(6Z)6(4((34dichlorobenzyl)oxy)3ethoxybenzylidene)5imino2(thiophen2yl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
CCOc1cc(ccc1OCc1ccc(c(c1)Cl)Cl)C=C1C(=O)N=c2n(C1=N)nc(s2)c1cccs1
MFCD03258579
STK047897
ZINC000097958637
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