Vitas-M small molecule compound
5-[(4-chloro-3,5-dimethylphenoxy)methyl]-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK448299
SMILES Clc1c(C)cc(cc1C)OCc1nnc(n1CC1CCCO1)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 C16H20ClN3O2S MW 353.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20ClN3O2S/c1-10-6-13(7-11(2)15(10)17)22-9-14-18-19-16(23)20(14)8-12-4-3-5-21-12/h6-7,12H,3-5,8-9H2,1-2H3,(H,19,23)InChIKey
DMKPALLDILJORO-UHFFFAOYSA-NSynonyms
3((4chloro35dimethylphenoxy)methyl)4(oxolan2ylmethyl)1H124triazole5thione
5((4CHLORO35DIMETHYLPHENOXY)METHYL)4(OXOLAN2YLMETHYL)124TRIAZOLE3THIOL
5((4chloro35dimethylphenoxy)methyl)4(tetrahydrofuran2ylmethyl)4H124triazole3thiol
CC1=CC(=CC(=C1Cl)C)OCC2=NNC(=S)N2CC3CCCO3
InChI=1SC16H20ClN3O2Sc110613(711(2)15(10)17)22914181916(23)20(14)8124352112h6712H3589H212H3(H1923)
MFCD04140514
ZINC000006922081
ZINC000006922082
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