Vitas-M small molecule compound
(6E)-6-{[1-(4-ethylphenyl)-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
STL224716
SMILES CCc1ccc(cc1)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 C26H22FN5OS MW 471.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22FN5OS/c1-4-17-5-11-21(12-6-17)31-15(2)13-19(16(31)3)14-22-23(28)32-26(29-24(22)33)34-25(30-32)18-7-9-20(27)10-8-18/h5-14,28H,4H2,1-3H3/b22-14+,28-23-InChIKey
AMWAPLCCMCEMAB-VZZOHWGESA-NSynonyms
862192-51-6(6E)6((1(4ethylphenyl)25dimethyl1Hpyrrol3yl)methylidene)2(4fluorophenyl)5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1(4ethylphenyl)25dimethyl1Hpyrrol3yl)methylene)2(4fluorophenyl)5imino5H(134)thiadiazolo(32a)pyrimidin7(6H)one
862192516
CCc1ccc(cc1)n1c(C)cc(c1C)C=C1C(=O)N=c2n(C1=N)nc(s2)c1ccc(cc1)F
MFCD05696374
ZINC000009293202
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