Vitas-M small molecule compound
(6Z)-2-cyclohexyl-6-(3,5-dichloro-4-hydroxybenzylidene)-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK093935
SMILES O=C1N=c2sc(nn2C(=N)/C/1=C/c1cc(Cl)c(c(c1)Cl)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 C18H16Cl2N4O2S MW 423.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16Cl2N4O2S/c19-12-7-9(8-13(20)14(12)25)6-11-15(21)24-18(22-16(11)26)27-17(23-24)10-4-2-1-3-5-10/h6-8,10,21,25H,1-5H2/b11-6-,21-15-InChIKey
AMBGBMZYKCQXSO-IZKYMZQSSA-NSynonyms
(6Z)2cyclohexyl6(35dichloro4hydroxybenzylidene)5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
MFCD03036835
O=C1N=c2sc(nn2C(=N)C1=Cc1cc(Cl)c(c(c1)Cl)O)C1CCCCC1
STK093935
ZINC000008721905
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