Vitas-M small molecule compound

4-ethyl-5-[2-(2-methylphenyl)quinolin-4-yl]-4H-1,2,4-triazole-3-thiol

Catalog ID
STK434530
SMILES CCn1c(S)nnc1c1cc(nc2c1cccc2)c1ccccc1C

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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 C20H18N4S MW 346.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4S/c1-3-24-19(22-23-20(24)25)16-12-18(14-9-5-4-8-13(14)2)21-17-11-7-6-10-15(16)17/h4-12H,3H2,1-2H3,(H,23,25)
InChIKey
INTCSNUGHYSZGC-UHFFFAOYSA-N
Synonyms

4ETHYL3(2(2METHYLPHENYL)QUINOLIN4YL)1H124TRIAZOLE5THIONE
4ETHYL5(2(2METHYLPHENYL)(4QUINOLYL))124TRIAZOLE3THIOL
4ethyl5(2(2methylphenyl)quinolin4yl)4H124triazole3thiol
CCN1C(=NNC1=S)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4C
InChI=1SC20H18N4Sc132419(222320(24)25)161218(14954813(14)2)211711761015(16)17h412H3H212H3(H2325)
MFCD03942574
ZINC000017072153
ZINC17072153

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Available files

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