Vitas-M small molecule compound
(6Z)-3-(benzylsulfanyl)-5-imino-6-(2,3,4-trimethoxybenzylidene)-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one
Catalog ID
STK065512
SMILES COc1c(ccc(c1OC)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 C22H20N4O4S2 MW 468.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4O4S2/c1-28-16-10-9-14(17(29-2)18(16)30-3)11-15-19(23)26-21(24-20(15)27)32-25-22(26)31-12-13-7-5-4-6-8-13/h4-11,23H,12H2,1-3H3/b15-11-,23-19-InChIKey
QBLTUBKNNFVNNZ-IXFCOSITSA-NSynonyms
827331-79-3(6Z)3(benzylsulfanyl)5imino6(234trimethoxybenzylidene)56dihydro7H(124)thiadiazolo(45a)pyrimidin7one
(Z)3(benzylthio)5imino6(234trimethoxybenzylidene)5H(124)thiadiazolo(45a)pyrimidin7(6H)one
827331793
COc1c(ccc(c1OC)OC)C=C1C(=O)N=c2n(C1=N)c(SCc1ccccc1)ns2
MFCD04006975
STK065512
ZINC000013751471
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