Vitas-M small molecule compound
methyl 4-[({5-oxo-6-[2-(propanoylamino)phenyl]-2,5-dihydro-1,2,4-triazin-3-yl}sulfanyl)methyl]benzoate
Catalog ID
STL571105
SMILES CCC(=O)Nc1ccccc1c1n[nH]c(nc1=O)SCc1ccc(cc1)C(=O)OC
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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 C21H20N4O4S MW 424.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O4S/c1-3-17(26)22-16-7-5-4-6-15(16)18-19(27)23-21(25-24-18)30-12-13-8-10-14(11-9-13)20(28)29-2/h4-11H,3,12H2,1-2H3,(H,22,26)(H,23,25,27)InChIKey
YOQHNXWTUCJIAE-UHFFFAOYSA-NSynonyms
135969724
InChI=1SC21H20N4O4Sc1317(26)2216754615(16)1819(27)2321(252418)30121381014(11913)20(28)292h411H312H212H3(H2226)(H232527)
methyl4(((5oxo6(2(propanoylamino)phenyl)25dihydro124triazin3yl)sulfanyl)methyl)benzoate
METHYL4(((5OXO6(2(PROPIONYLAMINO)PHENYL)45DIHYDRO124TRIAZIN3YL)THIO)METHYL)BENZOATE
methyl4((5oxo6(2(propanoylamino)phenyl)4H124triazin3yl)sulfanylmethyl)benzoate
MFCD32650200
ZINC000064774708
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