Vitas-M small molecule compound
(6E)-2-(4-fluorophenyl)-5-imino-6-{[1-(3-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL224734
SMILES COc1cccc(c1)n1c(C)cc(c1C)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)c1ccc(cc1)F
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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 C25H20FN5O2S MW 473.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20FN5O2S/c1-14-11-17(15(2)30(14)19-5-4-6-20(13-19)33-3)12-21-22(27)31-25(28-23(21)32)34-24(29-31)16-7-9-18(26)10-8-16/h4-13,27H,1-3H3/b21-12+,27-22-InChIKey
MIUJVWMFDKHJMD-OPDHIEIVSA-NSynonyms
877784-83-3(6E)2(4fluorophenyl)5imino6((1(3methoxyphenyl)25dimethyl1Hpyrrol3yl)methylidene)56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)2(4fluorophenyl)5imino6((1(3methoxyphenyl)25dimethyl1Hpyrrol3yl)methylene)5H(134)thiadiazolo(32a)pyrimidin7(6H)one
877784833
COc1cccc(c1)n1c(C)cc(c1C)C=C1C(=O)N=c2n(C1=N)nc(s2)c1ccc(cc1)F
MFCD05701077
ZINC000009293366
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