Vitas-M small molecule compound
(6E)-6-[(1-benzyl-2,5-dimethyl-1H-pyrrol-3-yl)methylidene]-2-(2-fluorophenyl)-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Catalog ID
STL145964
SMILES Fc1ccccc1c1nn2c(=NC(=O)/C(=C/c3cc(n(c3C)Cc3ccccc3)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 C25H20FN5OS MW 457.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20FN5OS/c1-15-12-18(16(2)30(15)14-17-8-4-3-5-9-17)13-20-22(27)31-25(28-23(20)32)33-24(29-31)19-10-6-7-11-21(19)26/h3-13,27H,14H2,1-2H3/b20-13+,27-22-InChIKey
RRIYQQBZNVMVIK-ZGKLTPNTSA-NSynonyms
862116-26-5(6E)6((1benzyl25dimethyl1Hpyrrol3yl)methylidene)2(2fluorophenyl)5imino56dihydro7H(134)thiadiazolo(32a)pyrimidin7one
(E)6((1benzyl25dimethyl1Hpyrrol3yl)methylene)2(2fluorophenyl)5imino5H(134)thiadiazolo(32a)pyrimidin7(6H)one
862116265
Fc1ccccc1c1nn2c(=NC(=O)C(=Cc3cc(n(c3C)Cc3ccccc3)C)C2=N)s1
MFCD05687041
ZINC000009498286
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