Vitas-M small molecule compound
4-(1,3-benzodioxol-5-yl)-5-ethyl-4H-1,2,4-triazole-3-thiol
Catalog ID
STK444733
SMILES CCc1nnc(n1c1ccc2c(c1)OCO2)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 C11H11N3O2S MW 249.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H11N3O2S/c1-2-10-12-13-11(17)14(10)7-3-4-8-9(5-7)16-6-15-8/h3-5H,2,6H2,1H3,(H,13,17)InChIKey
IQHSDAWNCLTGCE-UHFFFAOYSA-NSynonyms
4(13benzodioxol5yl)3ethyl1H124triazole5thione
4(13benzodioxol5yl)5ethyl4H124triazole3thiol
4(2HBENZO(34D)13DIOXOLAN5YL)5ETHYL124TRIAZOLE3THIOL
CCC1=NNC(=S)N1C2=CC3=C(C=C2)OCO3
InChI=1SC11H11N3O2Sc1210121311(17)14(10)73489(57)166158h35H26H21H3(H1317)
MFCD04057343
ZINC000006395582
ZINC06395582
ZINC6395582
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