Vitas-M small molecule compound

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

Catalog ID
STK927245
SMILES Cc1ccc(cc1)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 C17H15N3OS MW 309.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15N3OS/c1-13-7-9-14(10-8-13)16(21)11-22-17-18-12-20(19-17)15-5-3-2-4-6-15/h2-10,12H,11H2,1H3
InChIKey
ZFLIWQHKZFILLJ-UHFFFAOYSA-N
Synonyms

1(4METHYLPHENYL)2((1PHENYL124TRIAZOL3YL)SULFANYL)ETHANONE
1(4methylphenyl)2((1phenyl1H124triazol3yl)sulfanyl)ethanone
2(1PHENYL1H(124)TRIAZOL3YLSULFANYL)1PTOLYLETHANONE
CC1=CC=C(C=C1)C(=O)CSC2=NN(C=N2)C3=CC=CC=C3
InChI=1SC17H15N3OSc1137914(10813)16(21)112217181220(1917)155324615h21012H11H21H3
MFCD02045321
ZINC000004894852
ZINC04894852
ZINC4894852

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Available files

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