Vitas-M small molecule compound

4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(thiophen-2-yl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STK781757
SMILES Sc1nnc(n1c1ccc2c(c1)OCCO2)c1cccs1

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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 C14H11N3O2S2 MW 317.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11N3O2S2/c20-14-16-15-13(12-2-1-7-21-12)17(14)9-3-4-10-11(8-9)19-6-5-18-10/h1-4,7-8H,5-6H2,(H,16,20)
InChIKey
WDQQSIJRJNDAST-UHFFFAOYSA-N
Synonyms
728013-65-8
4(23DIHYDRO14BENZODIOXIN6YL)3THIOPHEN2YL1H124TRIAZOLE5THIONE
4(23DIHYDRO14BENZODIOXIN6YL)5(THIOPHEN2YL)24DIHYDRO3H124TRIAZOLE3THIONE
4(23DIHYDRO14BENZODIOXIN6YL)5(THIOPHEN2YL)4H124TRIAZOLE3THIOL
4(23dihydrobenzo(b)(14)dioxin6yl)5(thiophen2yl)4H124triazole3thiol
C1COC2=C(O1)C=CC(=C2)N3C(=NNC3=S)C4=CC=CS4
InChI=1SC14H11N3O2S2c2014161513(122172112)17(14)9341011(89)19651810h1478H56H2(H1620)
MFCD06015864
ZINC5706066

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Available files

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