Vitas-M small molecule compound
(6Z)-3-(benzylsulfanyl)-6-{4-[(4-chlorobenzyl)oxy]-3-ethoxybenzylidene}-5-imino-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one
Catalog ID
STK002514
SMILES CCOc1cc(ccc1OCc1ccc(cc1)Cl)/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 C28H23ClN4O3S2 MW 563.10 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23ClN4O3S2/c1-2-35-24-15-20(10-13-23(24)36-16-18-8-11-21(29)12-9-18)14-22-25(30)33-27(31-26(22)34)38-32-28(33)37-17-19-6-4-3-5-7-19/h3-15,30H,2,16-17H2,1H3/b22-14-,30-25-InChIKey
GLKITRJSICEDQB-ZLPQIYIZSA-NSynonyms
(6Z)3(benzylsulfanyl)6(4((4chlorobenzyl)oxy)3ethoxybenzylidene)5imino56dihydro7H(124)thiadiazolo(45a)pyrimidin7one
CCOc1cc(ccc1OCc1ccc(cc1)Cl)C=C1C(=O)N=c2n(C1=N)c(SCc1ccccc1)ns2
MFCD03574770
STK002514
ZINC000097957753
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