Vitas-M small molecule compound
(6Z)-2-(benzylsulfanyl)-6-(2,4-dimethoxybenzylidene)-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STK061738
SMILES COc1cc(OC)ccc1/C=C/1\C(=O)N=c2n(C1=N)nc(s2)SCc1ccccc1
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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 C21H18N4O3S2 MW 438.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N4O3S2/c1-27-15-9-8-14(17(11-15)28-2)10-16-18(22)25-20(23-19(16)26)30-21(24-25)29-12-13-6-4-3-5-7-13/h3-11,22H,12H2,1-2H3/b16-10-,22-18-InChIKey
QQXNXVGOLNBUDR-OOVWLKTBSA-NSynonyms
(6Z)2(benzylsulfanyl)6(24dimethoxybenzylidene)5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
COc1cc(OC)ccc1C=C1C(=O)N=c2n(C1=N)nc(s2)SCc1ccccc1
MFCD08051576
STK061738
ZINC000009553594
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