Vitas-M small molecule compound

N-(3,5-dimethylphenyl)-2-[(1-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide

Catalog ID
STL354311
SMILES O=C(Nc1cc(C)cc(c1)C)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 C18H18N4OS MW 338.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N4OS/c1-13-8-14(2)10-15(9-13)20-17(23)11-24-18-19-12-22(21-18)16-6-4-3-5-7-16/h3-10,12H,11H2,1-2H3,(H,20,23)
InChIKey
IWQYTKKBGLNODO-UHFFFAOYSA-N
Synonyms
511291-93-3
511291933
CC1=CC(=CC(=C1)NC(=O)CSC2=NN(C=N2)C3=CC=CC=C3)C
InChI=1SC18H18N4OSc113814(2)1015(913)2017(23)112418191222(2118)166435716h31012H11H212H3(H2023)
MFCD03772147
N(35DIMETHYLPHENYL)2((1PHENYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(35dimethylphenyl)2((1phenyl1H124triazol3yl)sulfanyl)acetamide
ZINC000004656059
ZINC04656059
ZINC4656059

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Available files

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