Vitas-M small molecule compound
5-(4,5-dibromothiophen-2-yl)-4-(3-methylphenyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK306758
SMILES Cc1cccc(c1)n1c(S)nnc1c1sc(c(c1)Br)Br
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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 C13H9Br2N3S2 MW 431.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H9Br2N3S2/c1-7-3-2-4-8(5-7)18-12(16-17-13(18)19)10-6-9(14)11(15)20-10/h2-6H,1H3,(H,17,19)InChIKey
KRQOIPAPNNEOOK-UHFFFAOYSA-NSynonyms
828284-35-13(45DIBROMOTHIOPHEN2YL)4(3METHYLPHENYL)1H124TRIAZOLE5THIONE
5(45dibromothiophen2yl)4(3methylphenyl)4H124triazole3thiol
828284351
CC1=CC(=CC=C1)N2C(=NNC2=S)C3=CC(=C(S3)Br)Br
InChI=1SC13H9Br2N3S2c173248(57)1812(161713(18)19)1069(14)11(15)2010h26H1H3(H1719)
MFCD04053580
ZINC000002791771
ZINC2791771
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