Vitas-M small molecule compound
(6Z)-2-cyclohexyl-6-{[1-(3-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL224515
SMILES Fc1cccc(c1)n1c(C)cc(c1C)/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 C24H24FN5OS MW 449.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24FN5OS/c1-14-11-17(15(2)29(14)19-10-6-9-18(25)13-19)12-20-21(26)30-24(27-22(20)31)32-23(28-30)16-7-4-3-5-8-16/h6,9-13,16,26H,3-5,7-8H2,1-2H3/b20-12-,26-21-InChIKey
MLEJVQZSRKGHRQ-RDKRLONDSA-NSynonyms
(6Z)2cyclohexyl6((1(3fluorophenyl)25dimethyl1Hpyrrol3yl)methylidene)5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)2cyclohexyl6((1(3fluorophenyl)25dimethyl1Hpyrrol3yl)methylene)5imino5H(134)thiadiazolo(32a)pyrimidin7(6H)one
MFCD24857799
ZINC000033887723
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