Vitas-M small molecule compound
(6E)-6-{[1-(2,5-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
STL224715
SMILES Fc1ccc(cc1)c1nn2c(=NC(=O)/C(=C/c3cc(n(c3C)c3cc(C)ccc3C)C)/C2=N)s1
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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/c1-14-5-6-15(2)22(11-14)31-16(3)12-19(17(31)4)13-21-23(28)32-26(29-24(21)33)34-25(30-32)18-7-9-20(27)10-8-18/h5-13,28H,1-4H3/b21-13+,28-23-InChIKey
XAPZVDYBBVORSU-SDCQNQORSA-NSynonyms
850159-86-3(6E)6((1(25dimethylphenyl)25dimethyl1Hpyrrol3yl)methylidene)2(4fluorophenyl)5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1(25dimethylphenyl)25dimethyl1Hpyrrol3yl)methylene)2(4fluorophenyl)5imino5H(134)thiadiazolo(32a)pyrimidin7(6H)one
850159863
Fc1ccc(cc1)c1nn2c(=NC(=O)C(=Cc3cc(n(c3C)c3cc(C)ccc3C)C)C2=N)s1
MFCD05690031
ZINC000009309703
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