Vitas-M small molecule compound

5-{2-[4-(propan-2-yloxy)phenyl]ethyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STL448052
SMILES C=CCn1c(CCc2ccc(cc2)OC(C)C)nnc1S

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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 C16H21N3OS MW 303.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21N3OS/c1-4-11-19-15(17-18-16(19)21)10-7-13-5-8-14(9-6-13)20-12(2)3/h4-6,8-9,12H,1,7,10-11H2,2-3H3,(H,18,21)
InChIKey
QEYIREPIRMQCDM-UHFFFAOYSA-N
Synonyms
510723-39-4
4allyl5(4isopropoxyphenethyl)4H124triazole3thiol
5(2(4(propan2yloxy)phenyl)ethyl)4(prop2en1yl)4H124triazole3thiol
MFCD03668067
ZINC000001247425

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Available files

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