Vitas-M small molecule compound

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

Catalog ID
STK512957
SMILES Cc1nnc(n1NCC#Cc1ccccc1)S

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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 C12H12N4S MW 244.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12N4S/c1-10-14-15-12(17)16(10)13-9-5-8-11-6-3-2-4-7-11/h2-4,6-7,13H,9H2,1H3,(H,15,17)
InChIKey
RWYKAXHPGHAERA-UHFFFAOYSA-N
Synonyms

3methyl4(3phenylprop2ynylamino)1H124triazole5thione
5METHYL4((3PHENYL2PROPYNYL)AMINO)4H124TRIAZOL3YLHYDROSULFIDE
5methyl4((3phenylprop2yn1yl)amino)4H124triazole3thiol
CC1=NNC(=S)N1NCC#CC2=CC=CC=C2
InChI=1SC12H12N4Sc110141512(17)16(10)13958116324711h246713H9H21H3(H1517)
MFCD12402105
ZINC000036235174
ZINC36235174

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Available files

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