Vitas-M small molecule compound

4-{[(1E,2E)-3-(furan-2-yl)prop-2-en-1-ylidene]amino}-5-(pyridin-4-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione

Catalog ID
STK565495
SMILES S=c1[nH]nc(n1/N=C/C=C/c1ccco1)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 C14H11N5OS MW 297.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11N5OS/c21-14-18-17-13(11-5-8-15-9-6-11)19(14)16-7-1-3-12-4-2-10-20-12/h1-10H,(H,18,21)/b3-1+,16-7+
InChIKey
MUSJFLNMBQBELM-JLALNBPMSA-N
Synonyms
488723-06-4
4(((1E2E)3(furan2yl)prop2en1ylidene)amino)5(pyridin4yl)24dihydro3H124triazole3thione
4(((E)3(2FURANYL)PROP2ENYLIDENE)AMINO)3PYRIDIN4YL1H124TRIAZOLE5THIONE
4(((E)3(2FURYL)PROP2ENYLIDENE)AMINO)3(4PYRIDYL)1H124TRIAZOLE5THIONE
4(((E)3(FURAN2YL)PROP2ENYLIDENE)AMINO)3PYRIDIN4YL1H124TRIAZOLE5THIONE
4((1E3E)4(2FURYL)1AZABUTA13DIENYL)5(4PYRIDYL)124TRIAZOLE3THIOL
4((3(2FURYL)2PROPEN1YLIDENE)AMINO)5(4PYRIDINYL)4H124TRIAZOLE3THIOL
4((E)((E)3(FURAN2YL)PROP2ENYLIDENE)AMINO)3PYRIDIN4YL1H124TRIAZOLE5THIONE
488723064
C1=COC(=C1)C=CC=NN2C(=NNC2=S)C3=CC=NC=C3
InChI=1SC14H11N5OSc2114181713(1158159611)19(14)167131242102012h110H(H1821)b31+167+
MFCD03809370
S=c1(nH)nc(n1N=CC=Cc1ccco1)c1ccncc1
ZINC000002337526
ZINC15986350

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Available files

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