Vitas-M small molecule compound

4-{[(E)-(4-nitrophenyl)methylidene]amino}-5-(pyridin-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione

Catalog ID
STL057522
SMILES [O-][N+](=O)c1ccc(cc1)/C=N/n1c(=S)[nH]nc1c1ccccn1

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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 C14H10N6O2S MW 326.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H10N6O2S/c21-20(22)11-6-4-10(5-7-11)9-16-19-13(17-18-14(19)23)12-3-1-2-8-15-12/h1-9H,(H,18,23)/b16-9+
InChIKey
NEHXJRXFWKPPNL-CXUHLZMHSA-N
Synonyms
497823-91-3
(O)(N+)(=O)c1ccc(cc1)C=Nn1c(=S)(nH)nc1c1ccccn1
4(((E)(4nitrophenyl)methylidene)amino)5(pyridin2yl)24dihydro3H124triazole3thione
4((1E)2(4NITROPHENYL)1AZAVINYL)5(2PYRIDYL)124TRIAZOLE3THIOL
4((E)(4NITROPHENYL)METHYLIDENEAMINO)3PYRIDIN2YL1H124TRIAZOLE5THIONE
497823913
C1=CC=NC(=C1)C2=NNC(=S)N2N=CC3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC14H10N6O2Sc2120(22)116410(5711)9161913(171814(19)23)1231281512h19H(H1823)b169+
MFCD05724993
ZINC000006000472
ZINC33322783

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Available files

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