Vitas-M small molecule compound

(6E)-6-{[1-(3,4-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-(4-fluorophenyl)-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

Catalog ID
STL145979
SMILES Fc1ccc(cc1)c1sc2=NC(=O)/C(=C/c3cc(n(c3C)c3ccc(c(c3)C)C)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 C26H22FN5OS MW 471.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22FN5OS/c1-14-5-10-21(11-15(14)2)31-16(3)12-19(17(31)4)13-22-23(28)32-26(29-24(22)33)34-25(30-32)18-6-8-20(27)9-7-18/h5-13,28H,1-4H3/b22-13+,28-23-
InChIKey
MADBSTSQURMMOF-GSVAUOJLSA-N
Synonyms
862208-57-9
(6E)6((1(34dimethylphenyl)25dimethyl1Hpyrrol3yl)methylidene)2(4fluorophenyl)5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1(34dimethylphenyl)25dimethyl1Hpyrrol3yl)methylene)2(4fluorophenyl)5imino5H(134)thiadiazolo(32a)pyrimidin7(6H)one
862208579
Fc1ccc(cc1)c1sc2=NC(=O)C(=Cc3cc(n(c3C)c3ccc(c(c3)C)C)C)C(=N)n2n1
MFCD05697540
ZINC000009292086

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Available files

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