Vitas-M small molecule compound

4-[(3-phenylprop-2-yn-1-yl)amino]-4H-1,2,4-triazole-3-thiol

Catalog ID
STL507794
SMILES Sc1nncn1NCC#Cc1ccccc1

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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 C11H10N4S MW 230.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H10N4S/c16-11-14-12-9-15(11)13-8-4-7-10-5-2-1-3-6-10/h1-3,5-6,9,13H,8H2,(H,14,16)
InChIKey
PPUNFOAYMCNBTD-UHFFFAOYSA-N
Synonyms

132452320
4((3phenylprop2yn1yl)amino)4H124triazole3thiol
4(3phenylprop2ynylamino)1~(H)124triazole5thione
InChI=1SC11H10N4Sc16111412915(11)13847105213610h1356913H8H2(H1416)
MFCD31614605
ZINC001505838630

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Available files

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