Vitas-M small molecule compound
(6E)-6-{[2,5-dimethyl-1-(naphthalen-1-yl)-1H-pyrrol-3-yl]methylidene}-5-imino-2-(methylsulfanyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL224490
SMILES CSc1nn2c(=NC(=O)/C(=C/c3cc(n(c3C)c3cccc4c3cccc4)C)/C2=N)s1
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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 C23H19N5OS2 MW 445.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N5OS2/c1-13-11-16(12-18-20(24)28-22(25-21(18)29)31-23(26-28)30-3)14(2)27(13)19-10-6-8-15-7-4-5-9-17(15)19/h4-12,24H,1-3H3/b18-12+,24-20-InChIKey
BJTBUAJFOKDNGM-VEMLYASCSA-NSynonyms
862489-56-3(6E)6((25dimethyl1(naphthalen1yl)1Hpyrrol3yl)methylidene)5imino2(methylsulfanyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((25dimethyl1(naphthalen1yl)1Hpyrrol3yl)methylene)5imino2(methylthio)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
862489563
CSc1nn2c(=NC(=O)C(=Cc3cc(n(c3C)c3cccc4c3cccc4)C)C2=N)s1
MFCD05699485
ZINC000009293278
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