Vitas-M small molecule compound
(6E)-6-{[2,5-dimethyl-1-(4-methylphenyl)-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
STL032759
SMILES CSc1nn2c(=NC(=O)/C(=C/c3cc(n(c3C)c3ccc(cc3)C)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 C20H19N5OS2 MW 409.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N5OS2/c1-11-5-7-15(8-6-11)24-12(2)9-14(13(24)3)10-16-17(21)25-19(22-18(16)26)28-20(23-25)27-4/h5-10,21H,1-4H3/b16-10+,21-17-InChIKey
QUCZGHYBRFETMI-CGJQJJPJSA-NSynonyms
896808-26-7(6E)6((25dimethyl1(4methylphenyl)1Hpyrrol3yl)methylidene)5imino2(methylsulfanyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((25dimethyl1(ptolyl)1Hpyrrol3yl)methylene)5imino2(methylthio)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
896808267
CSc1nn2c(=NC(=O)C(=Cc3cc(n(c3C)c3ccc(cc3)C)C)C2=N)s1
MFCD06595640
ZINC000005342017
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