Vitas-M small molecule compound
(6Z)-6-[(1-benzyl-2,5-dimethyl-1H-pyrrol-3-yl)methylidene]-5-imino-2-phenyl-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL224437
SMILES Cc1cc(c(n1Cc1ccccc1)C)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)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 C25H21N5OS MW 439.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N5OS/c1-16-13-20(17(2)29(16)15-18-9-5-3-6-10-18)14-21-22(26)30-25(27-23(21)31)32-24(28-30)19-11-7-4-8-12-19/h3-14,26H,15H2,1-2H3/b21-14-,26-22-InChIKey
DCUGTWUYNGUNPO-NLAALYTPSA-NSynonyms
(6Z)6((1benzyl25dimethyl1Hpyrrol3yl)methylidene)5imino2phenyl56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1benzyl25dimethyl1Hpyrrol3yl)methylene)5imino2phenyl5H(134)thiadiazolo(32a)pyrimidin7(6H)one
Cc1cc(c(n1Cc1ccccc1)C)C=C1C(=O)N=c2n(C1=N)nc(s2)c1ccccc1
MFCD24857771
ZINC000033797298
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