Vitas-M small molecule compound
4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-{[(4-methylbenzyl)sulfanyl]methyl}-4H-1,2,4-triazole-3-thiol
Catalog ID
STK447155
SMILES Cc1ccc(cc1)CSCc1nnc(n1c1ccc2c(c1)OCCO2)S
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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 C19H19N3O2S2 MW 385.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O2S2/c1-13-2-4-14(5-3-13)11-26-12-18-20-21-19(25)22(18)15-6-7-16-17(10-15)24-9-8-23-16/h2-7,10H,8-9,11-12H2,1H3,(H,21,25)InChIKey
UFXBLUFYVZGUQM-UHFFFAOYSA-NSynonyms
4(23dihydro14benzodioxin6yl)3((4methylphenyl)methylsulfanylmethyl)1H124triazole5thione
4(23dihydro14benzodioxin6yl)5(((4methylbenzyl)sulfanyl)methyl)4H124triazole3thiol
4(2H3HBENZO(34E)14DIOXAN6YL)5(((4METHYLPHENYL)METHYLTHIO)METHYL)124TRIAZOLE3THIOL
CC1=CC=C(C=C1)CSCC2=NNC(=S)N2C3=CC4=C(C=C3)OCCO4
InChI=1SC19H19N3O2S2c1132414(5313)11261218202119(25)22(18)15671617(1015)24982316h2710H891112H21H3(H2125)
MFCD04059988
ZINC000006400776
ZINC06400776
ZINC6400776
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