Vitas-M small molecule compound
(6Z)-2-benzyl-6-{[1-(2-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
STL224578
SMILES Fc1ccccc1n1c(C)cc(c1C)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)Cc1ccccc1
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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 C25H20FN5OS MW 457.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20FN5OS/c1-15-12-18(16(2)30(15)21-11-7-6-10-20(21)26)14-19-23(27)31-25(28-24(19)32)33-22(29-31)13-17-8-4-3-5-9-17/h3-12,14,27H,13H2,1-2H3/b19-14-,27-23-InChIKey
YUXYEUSBERVDEX-XHDLJJFRSA-NSynonyms
(6Z)2benzyl6((1(2fluorophenyl)25dimethyl1Hpyrrol3yl)methylidene)5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)2benzyl6((1(2fluorophenyl)25dimethyl1Hpyrrol3yl)methylene)5imino5H(134)thiadiazolo(32a)pyrimidin7(6H)one
Fc1ccccc1n1c(C)cc(c1C)C=C1C(=O)N=c2n(C1=N)nc(s2)Cc1ccccc1
MFCD24857820
ZINC000033528698
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