Vitas-M small molecule compound
(6E)-2-(4-fluorophenyl)-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
STL224629
SMILES Fc1ccc(cc1)c1sc2=NC(=O)/C(=C/c3cc(n(c3C)c3cccc(c3)F)C)/C(=N)n2n1
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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 C24H17F2N5OS MW 461.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17F2N5OS/c1-13-10-16(14(2)30(13)19-5-3-4-18(26)12-19)11-20-21(27)31-24(28-22(20)32)33-23(29-31)15-6-8-17(25)9-7-15/h3-12,27H,1-2H3/b20-11+,27-21-InChIKey
LBNZLKVTJGWPRU-FSHYXBHWSA-NSynonyms
862104-48-1(6E)2(4fluorophenyl)6((1(3fluorophenyl)25dimethyl1Hpyrrol3yl)methylidene)5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)2(4fluorophenyl)6((1(3fluorophenyl)25dimethyl1Hpyrrol3yl)methylene)5imino5H(134)thiadiazolo(32a)pyrimidin7(6H)one
862104481
Fc1ccc(cc1)c1sc2=NC(=O)C(=Cc3cc(n(c3C)c3cccc(c3)F)C)C(=N)n2n1
MFCD05686649
ZINC000009309322
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