Vitas-M small molecule compound

1-(3,5-dimethylpiperidin-1-yl)-2-[(1-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanone

Catalog ID
STL294348
SMILES CC1CC(C)CN(C1)C(=O)CSc1ncn(n1)c1ccccc1

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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 C17H22N4OS MW 330.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N4OS/c1-13-8-14(2)10-20(9-13)16(22)11-23-17-18-12-21(19-17)15-6-4-3-5-7-15/h3-7,12-14H,8-11H2,1-2H3
InChIKey
AKZZVNGDPJHFLB-UHFFFAOYSA-N
Synonyms
925079-67-0
1(35dimethylpiperidin1yl)2((1phenyl124triazol3yl)sulfanyl)ethanone
1(35dimethylpiperidin1yl)2((1phenyl1H124triazol3yl)sulfanyl)ethanone
925079670
CC1CC(CN(C1)C(=O)CSC2=NN(C=N2)C3=CC=CC=C3)C
InChI=1SC17H22N4OSc113814(2)1020(913)16(22)112317181221(1917)156435715h371214H811H212H3
MFCD09156270
ZINC000008762015
ZINC000018068146

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Available files

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