Vitas-M small molecule compound

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

Catalog ID
STK434110
SMILES Cn1c(S)nnc1c1cc(nc2c1cccc2)c1ccncc1

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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 C17H13N5S MW 319.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13N5S/c1-22-16(20-21-17(22)23)13-10-15(11-6-8-18-9-7-11)19-14-5-3-2-4-12(13)14/h2-10H,1H3,(H,21,23)
InChIKey
CODFZJRAWCPXSN-UHFFFAOYSA-N
Synonyms

4METHYL3(2PYRIDIN4YLQUINOLIN4YL)1H124TRIAZOLE5THIONE
4METHYL5(2(4PYRIDYL)(4QUINOLYL))124TRIAZOLE3THIOL
4methyl5(2(pyridin4yl)quinolin4yl)4H124triazole3thiol
CN1C(=NNC1=S)C2=CC(=NC3=CC=CC=C32)C4=CC=NC=C4
InChI=1SC17H13N5Sc12216(202117(22)23)131015(1168189711)1914532412(13)14h210H1H3(H2123)
MFCD03943423
ZINC000017054948
ZINC17054948

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Available files

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