Vitas-M small molecule compound

5-(4-ethyl-5-methylthiophen-3-yl)-4-(2-methylpropyl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STK449804
SMILES CCc1c(C)scc1c1nnc(n1CC(C)C)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 C13H19N3S2 MW 281.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H19N3S2/c1-5-10-9(4)18-7-11(10)12-14-15-13(17)16(12)6-8(2)3/h7-8H,5-6H2,1-4H3,(H,15,17)
InChIKey
DFAXOLBTMACEGC-UHFFFAOYSA-N
Synonyms

3(4ETHYL5METHYLTHIOPHEN3YL)4(2METHYLPROPYL)1H124TRIAZOLE5THIONE
5(4ETHYL5METHYL(3THIENYL))4(2METHYLPROPYL)124TRIAZOLE3THIOL
5(4ETHYL5METHYL3THIENYL)4ISOBUTYL4H124TRIAZOL3YLHYDROSULFIDE
5(4ethyl5methylthiophen3yl)4(2methylpropyl)4H124triazole3thiol
CCC1=C(SC=C1C2=NNC(=S)N2CC(C)C)C
InChI=1SC13H19N3S2c15109(4)18711(10)12141513(17)16(12)68(2)3h78H56H214H3(H1517)
MFCD03467678
ZINC000006519530
ZINC06519530
ZINC6519530

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Available files

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