Vitas-M small molecule compound

3-(4-fluorophenyl)-4-methyl-5-[(2-phenoxyethyl)sulfanyl]-4H-1,2,4-triazole

Catalog ID
STK261227
SMILES Fc1ccc(cc1)c1nnc(n1C)SCCOc1ccccc1

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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 C17H16FN3OS MW 329.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16FN3OS/c1-21-16(13-7-9-14(18)10-8-13)19-20-17(21)23-12-11-22-15-5-3-2-4-6-15/h2-10H,11-12H2,1H3
InChIKey
OHHZPGXMWLOZDO-UHFFFAOYSA-N
Synonyms

3(4fluorophenyl)4methyl5((2phenoxyethyl)sulfanyl)4H124triazole
3(4FLUOROPHENYL)4METHYL5(2PHENOXYETHYLSULFANYL)124TRIAZOLE
3(4FLUOROPHENYL)4METHYL5(2PHENOXYETHYLSULFANYL)4H(124)TRIAZOLE
CN1C(=NN=C1SCCOC2=CC=CC=C2)C3=CC=C(C=C3)F
InChI=1SC17H16FN3OSc12116(137914(18)10813)192017(21)23121122155324615h210H1112H21H3
MFCD07792571
ZINC000004993590
ZINC04993590
ZINC4993590

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Available files

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