Vitas-M small molecule compound
1-[5-{[(5-methylfuran-2-yl)methyl]amino}-3-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl]butan-1-one
Catalog ID
STK246561
SMILES CCCC(=O)n1nc(nc1NCc1ccc(o1)C)c1cccs1
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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 C16H18N4O2S MW 330.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N4O2S/c1-3-5-14(21)20-16(17-10-12-8-7-11(2)22-12)18-15(19-20)13-6-4-9-23-13/h4,6-9H,3,5,10H2,1-2H3,(H,17,18,19)InChIKey
HMWNFCADCMUVID-UHFFFAOYSA-NSynonyms
1(5(((5methylfuran2yl)methyl)amino)3(thiophen2yl)1H124triazol1yl)butan1one
1(5((5methylfuran2yl)methylamino)3thiophen2yl124triazol1yl)butan1one
CCCC(=O)N1C(=NC(=N1)C2=CC=CS2)NCC3=CC=C(O3)C
InChI=1SC16H18N4O2Sc13514(21)2016(1710128711(2)2212)1815(1920)136492313h469H3510H212H3(H171819)
MFCD08685177
ZINC000009667678
ZINC09667678
ZINC9667678
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