Vitas-M small molecule compound
(6E)-6-{[1-(3-chloro-4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-5-imino-2-(2-methylpropyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL224591
SMILES CC(Cc1nn2c(=NC(=O)/C(=C/c3cc(n(c3C)c3ccc(c(c3)Cl)F)C)/C2=N)s1)C
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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 C22H21ClFN5OS MW 457.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClFN5OS/c1-11(2)7-19-27-29-20(25)16(21(30)26-22(29)31-19)9-14-8-12(3)28(13(14)4)15-5-6-18(24)17(23)10-15/h5-6,8-11,25H,7H2,1-4H3/b16-9+,25-20-InChIKey
OYIRVDUECZRYRG-GDXMJORLSA-NSynonyms
848986-62-9(6E)6((1(3chloro4fluorophenyl)25dimethyl1Hpyrrol3yl)methylidene)5imino2(2methylpropyl)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1(3chloro4fluorophenyl)25dimethyl1Hpyrrol3yl)methylene)5imino2isobutyl5H(134)thiadiazolo(32a)pyrimidin7(6H)one
848986629
CC(Cc1nn2c(=NC(=O)C(=Cc3cc(n(c3C)c3ccc(c(c3)Cl)F)C)C2=N)s1)C
MFCD05678497
ZINC000009233326
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Check stock on Vitas-MAvailable files
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