Vitas-M small molecule compound

1-{3-(furan-2-yl)-5-[(thiophen-2-ylmethyl)amino]-1H-1,2,4-triazol-1-yl}-2-methylpropan-1-one

Catalog ID
STK211671
SMILES O=C(n1nc(nc1NCc1cccs1)c1ccco1)C(C)C

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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 C15H16N4O2S MW 316.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16N4O2S/c1-10(2)14(20)19-15(16-9-11-5-4-8-22-11)17-13(18-19)12-6-3-7-21-12/h3-8,10H,9H2,1-2H3,(H,16,17,18)
InChIKey
XGBFJZOSVMSQLI-UHFFFAOYSA-N
Synonyms
876714-38-4
1(3(FURAN2YL)5((THIOPHEN2YLMETHYL)AMINO)1H124TRIAZOL1YL)2METHYLPROPAN1ONE
1(3(FURAN2YL)5(THIOPHEN2YLMETHYLAMINO)124TRIAZOL1YL)2METHYLPROPAN1ONE
876714384
CC(C)C(=O)N1C(=NC(=N1)C2=CC=CO2)NCC3=CC=CS3
InChI=1SC15H16N4O2Sc110(2)14(20)1915(169115482211)1713(1819)126372112h3810H9H212H3(H161718)
MFCD07393314
ZINC000004777313
ZINC04777313
ZINC4777313

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.