Vitas-M small molecule compound

4-methyl-5-(2-phenylethyl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STK415376
SMILES Sc1nnc(n1C)CCc1ccccc1

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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 C11H13N3S MW 219.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H13N3S/c1-14-10(12-13-11(14)15)8-7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H,13,15)
InChIKey
KISPWNDSNLAABQ-UHFFFAOYSA-N
Synonyms
663181-83-7
4methyl3(2phenylethyl)1H124triazole5thione
4METHYL3PHENETHYL1H124TRIAZOLE5THIONE
4METHYL5(2PHENYLETHYL)124TRIAZOLE3THIOL
4methyl5(2phenylethyl)4H124triazole3thiol
4METHYL5PHENETHYL4H(124)TRIAZOLE3THIOL
4METHYL5PHENETHYL4H124TRIAZOLE3THIOL
663181837
CN1C(=NNC1=S)CCC2=CC=CC=C2
InChI=1SC11H13N3Sc11410(121311(14)15)879532469h26H78H21H3(H1315)
MFCD03900478
ZINC000013115220
ZINC13115220

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Available files

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