Vitas-M small molecule compound

5-(furan-2-yl)-4-{[(E)-(1-methyl-1H-pyrrol-2-yl)methylidene]amino}-4H-1,2,4-triazole-3-thiol

Catalog ID
STL308106
SMILES Sc1nnc(n1/N=C/c1cccn1C)c1ccco1

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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 C12H11N5OS MW 273.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11N5OS/c1-16-6-2-4-9(16)8-13-17-11(14-15-12(17)19)10-5-3-7-18-10/h2-8H,1H3,(H,15,19)/b13-8+
InChIKey
OAYJZOZNUBOJJR-MDWZMJQESA-N
Synonyms
488715-28-2
(E)5(furan2yl)4(((1methyl1Hpyrrol2yl)methylene)amino)4H124triazole3thiol
3(2FURANYL)4((1METHYL2PYRROLYL)METHYLIDENEAMINO)1H124TRIAZOLE5THIONE
3(2FURYL)4((1METHYLPYRROL2YL)METHYLENEAMINO)1H124TRIAZOLE5THIONE
3(FURAN2YL)4((1METHYLPYRROL2YL)METHYLIDENEAMINO)1H124TRIAZOLE5THIONE
3(FURAN2YL)4((E)(1METHYLPYRROL2YL)METHYLIDENEAMINO)1H124TRIAZOLE5THIONE
4((1E)2(1METHYLPYRROL2YL)1AZAVINYL)5(2FURYL)124TRIAZOLE3THIOL
488715282
5(2FURYL)4(((1METHYL1HPYRROL2YL)METHYLENE)AMINO)4H124TRIAZOLE3THIOL
5(furan2yl)4(((E)(1methyl1Hpyrrol2yl)methylidene)amino)4H124triazole3thiol
CN1C=CC=C1C=NN2C(=NNC2=S)C3=CC=CO3
InChI=1SC12H11N5OSc1166249(16)8131711(141512(17)19)105371810h28H1H3(H1519)b138+
MFCD03221801
Sc1nnc(n1N=Cc1cccn1C)c1ccco1
ZINC000009059090
ZINC13115271

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Available files

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