Vitas-M small molecule compound

4-{[(1E,2E)-3-phenylprop-2-en-1-ylidene]amino}-5-(pyridin-3-yl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STL308101
SMILES Sc1nnc(n1/N=C/C=C/c1ccccc1)c1cccnc1

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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 C16H13N5S MW 307.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13N5S/c22-16-20-19-15(14-9-5-10-17-12-14)21(16)18-11-4-8-13-6-2-1-3-7-13/h1-12H,(H,20,22)/b8-4+,18-11+
InChIKey
RARNRBLSPYYIFW-VZGYRVSQSA-N
Synonyms
89814-03-9
4(((1E2E)3phenylprop2en1ylidene)amino)5(pyridin3yl)4H124triazole3thiol
4(((E)3PHENYLPROP2ENYLIDENE)AMINO)3(3PYRIDINYL)1H124TRIAZOLE5THIONE
4(((E)3PHENYLPROP2ENYLIDENE)AMINO)3(3PYRIDYL)1H124TRIAZOLE5THIONE
4(((E)3PHENYLPROP2ENYLIDENE)AMINO)3PYRIDIN3YL1H124TRIAZOLE5THIONE
4((1E3E)4PHENYL1AZABUTA13DIENYL)5(3PYRIDYL)124TRIAZOLE3THIOL
4((E)((E)3phenylallylidene)amino)5(pyridin3yl)4H124triazole3thiol
4((E)((E)3PHENYLPROP2ENYLIDENE)AMINO)3PYRIDIN3YL1H124TRIAZOLE5THIONE
4((E)3PHENYLPROP2EN(E)YLIDENEAMINO)5PYRIDIN3YL4H(124)TRIAZOLE3THIOL
89814039
C1=CC=C(C=C1)C=CC=NN2C(=NNC2=S)C3=CN=CC=C3
InChI=1SC16H13N5Sc2216201915(149510171214)21(16)181148136213713h112H(H2022)b84+1811+
MFCD03221594
Sc1nnc(n1N=CC=Cc1ccccc1)c1cccnc1
ZINC000006228022
ZINC15979064

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Available files

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