Vitas-M small molecule compound
(6Z)-6-{[1-(3-chloro-4-methoxyphenyl)-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
STL224893
SMILES COc1ccc(cc1Cl)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 C25H20ClN5O2S MW 489.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20ClN5O2S/c1-14-11-17(15(2)30(14)18-9-10-21(33-3)20(26)13-18)12-19-22(27)31-25(28-23(19)32)34-24(29-31)16-7-5-4-6-8-16/h4-13,27H,1-3H3/b19-12-,27-22-InChIKey
ZTLJQSFVFZBBPC-PMFZMJORSA-NSynonyms
(6Z)6((1(3chloro4methoxyphenyl)25dimethyl1Hpyrrol3yl)methylidene)5imino2phenyl56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1(3chloro4methoxyphenyl)25dimethyl1Hpyrrol3yl)methylene)5imino2phenyl5H(134)thiadiazolo(32a)pyrimidin7(6H)one
COc1ccc(cc1Cl)n1c(C)cc(c1C)C=C1C(=O)N=c2n(C1=N)nc(s2)c1ccccc1
MFCD24857939
ZINC000036589830
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