Vitas-M small molecule compound

3-(benzylsulfanyl)-5-(4-fluorophenyl)-4H-1,2,4-triazol-4-amine

Catalog ID
STL347401
SMILES Fc1ccc(cc1)c1nnc(n1N)SCc1ccccc1

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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 C15H13FN4S MW 300.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13FN4S/c16-13-8-6-12(7-9-13)14-18-19-15(20(14)17)21-10-11-4-2-1-3-5-11/h1-9H,10,17H2
InChIKey
HDXDGLKKJBXVIN-UHFFFAOYSA-N
Synonyms
353287-99-7
3(benzylsulfanyl)5(4fluorophenyl)4H124triazol4amine
3(benzylthio)5(4fluorophenyl)4H124triazol4amine
353287997
3BENZYLSULFANYL5(4FLUOROPHENYL)124TRIAZOL4AMINE
5(4FLUOROPHENYL)3(PHENYLMETHYLTHIO)124TRIAZOLE4YLAMINE
C1=CC=C(C=C1)CSC2=NN=C(N2N)C3=CC=C(C=C3)F
InChI=1SC15H13FN4Sc16138612(7913)14181915(20(14)17)2110114213511h19H1017H2
MFCD02325849
ZINC000000481673
ZINC00481673
ZINC481673

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Available files

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