Vitas-M small molecule compound

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

Catalog ID
STK564414
SMILES Cc1ccc(s1)/C=N/n1c(=S)[nH]nc1c1cccnc1

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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 C13H11N5S2 MW 301.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11N5S2/c1-9-4-5-11(20-9)8-15-18-12(16-17-13(18)19)10-3-2-6-14-7-10/h2-8H,1H3,(H,17,19)/b15-8+
InChIKey
QWZADTPBTOHMHZ-OVCLIPMQSA-N
Synonyms
489421-82-1
4(((E)(5methylthiophen2yl)methylidene)amino)5(pyridin3yl)24dihydro3H124triazole3thione
4((1(5METHYLTHIOPHEN2YL)METH(E)YLIDENE)AMINO)5PYRIDIN3YL4H(124)TRIAZOLE3THIOL
4((1E)2(5METHYL(2THIENYL))1AZAVINYL)5(3PYRIDYL)124TRIAZOLE3THIOL
4((5METHYL2THIENYL)METHYLENEAMINO)3(3PYRIDYL)1H124TRIAZOLE5THIONE
4((5METHYL2THIOPHENYL)METHYLIDENEAMINO)3(3PYRIDINYL)1H124TRIAZOLE5THIONE
4((5METHYLTHIOPHEN2YL)METHYLIDENEAMINO)3PYRIDIN3YL1H124TRIAZOLE5THIONE
4((E)(5METHYLTHIOPHEN2YL)METHYLIDENEAMINO)3PYRIDIN3YL1H124TRIAZOLE5THIONE
489421821
CC1=CC=C(S1)C=NN2C(=NNC2=S)C3=CN=CC=C3
Cc1ccc(s1)C=Nn1c(=S)(nH)nc1c1cccnc1
InChI=1SC13H11N5S2c194511(209)8151812(161713(18)19)1032614710h28H1H3(H1719)b158+
MFCD03801932
ZINC000001240883
ZINC1240882

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Available files

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