Vitas-M small molecule compound
methyl (2Z)-5-(3-fluorophenyl)-2-{[(3-methyl-4-oxo-3,4-dihydrophthalazin-1-yl)carbonyl]imino}-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL248907
SMILES COC(=O)c1[nH]/c(=N/C(=O)c2nn(C)c(=O)c3c2cccc3)/sc1c1cccc(c1)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 C21H15FN4O4S MW 438.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15FN4O4S/c1-26-19(28)14-9-4-3-8-13(14)15(25-26)18(27)24-21-23-16(20(29)30-2)17(31-21)11-6-5-7-12(22)10-11/h3-10H,1-2H3,(H,23,24,27)InChIKey
BBALVTAFLUGRFX-UHFFFAOYSA-NSynonyms
1374525-33-31374525333
COC(=O)c1(nH)c(=NC(=O)c2nn(C)c(=O)c3c2cccc3)sc1c1cccc(c1)F
methyl(2Z)5(3fluorophenyl)2(((3methyl4oxo34dihydrophthalazin1yl)carbonyl)imino)23dihydro13thiazole4carboxylate
MFCD24861350
ZINC000072406151
ZINC72406151
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