Vitas-M small molecule compound
(6Z)-3-(benzylsulfanyl)-6-{4-[2-(2-chlorophenoxy)ethoxy]-3,5-dimethoxybenzylidene}-5-imino-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one
Catalog ID
STK069943
SMILES COc1cc(cc(c1OCCOc1ccccc1Cl)OC)/C=C/1\C(=O)N=c2n(C1=N)c(SCc1ccccc1)ns2
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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 C29H25ClN4O5S2 MW 609.13 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25ClN4O5S2/c1-36-23-15-19(16-24(37-2)25(23)39-13-12-38-22-11-7-6-10-21(22)30)14-20-26(31)34-28(32-27(20)35)41-33-29(34)40-17-18-8-4-3-5-9-18/h3-11,14-16,31H,12-13,17H2,1-2H3/b20-14-,31-26-InChIKey
KYAAIDUPFLZOMA-DNYYRQADSA-NSynonyms
(6Z)3(benzylsulfanyl)6(4(2(2chlorophenoxy)ethoxy)35dimethoxybenzylidene)5imino56dihydro7H(124)thiadiazolo(45a)pyrimidin7one
COc1cc(cc(c1OCCOc1ccccc1Cl)OC)C=C1C(=O)N=c2n(C1=N)c(SCc1ccccc1)ns2
MFCD05977893
STK069943
ZINC000097961913
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