Vitas-M small molecule compound

4-({(E)-[4-(diethylamino)phenyl]methylidene}amino)-5-(2-fluorophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione

Catalog ID
STK596145
SMILES CCN(c1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1ccccc1F)CC

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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 C19H20FN5S MW 369.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20FN5S/c1-3-24(4-2)15-11-9-14(10-12-15)13-21-25-18(22-23-19(25)26)16-7-5-6-8-17(16)20/h5-13H,3-4H2,1-2H3,(H,23,26)/b21-13+
InChIKey
IDOGFLWNNKGIOQ-FYJGNVAPSA-N
Synonyms
573971-68-3
4(((E)(4(diethylamino)phenyl)methylidene)amino)5(2fluorophenyl)24dihydro3H124triazole3thione
4((1E)2(4(DIETHYLAMINO)PHENYL)1AZAVINYL)5(2FLUOROPHENYL)124TRIAZOLE3THIOL
4((4(DIETHYLAMINO)BENZYLIDENE)AMINO)3(2FLUOROPHENYL)1H124TRIAZOLE5(4H)THIONE
4((E)(4(DIETHYLAMINO)PHENYL)METHYLIDENEAMINO)3(2FLUOROPHENYL)1H124TRIAZOLE5THIONE
573971683
CCN(c1ccc(cc1)C=Nn1c(=S)(nH)nc1c1ccccc1F)CC
CCN(CC)C1=CC=C(C=C1)C=NN2C(=NNC2=S)C3=CC=CC=C3F
InChI=1SC19H20FN5Sc1324(42)1511914(101215)13212518(222319(25)26)16756817(16)20h513H34H212H3(H2326)b2113+
MFCD07203270
ZINC000005694977
ZINC2366453

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Available files

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