Vitas-M small molecule compound
3-(benzylsulfanyl)-5-(3,5-dimethoxyphenyl)-4H-1,2,4-triazole
Catalog ID
STL417532
SMILES COc1cc(OC)cc(c1)c1nnc([nH]1)SCc1ccccc1
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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 C17H17N3O2S MW 327.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O2S/c1-21-14-8-13(9-15(10-14)22-2)16-18-17(20-19-16)23-11-12-6-4-3-5-7-12/h3-10H,11H2,1-2H3,(H,18,19,20)InChIKey
SJFHWUASOBZWMG-UHFFFAOYSA-NSynonyms
3(benzylsulfanyl)5(35dimethoxyphenyl)4H124triazole
3BENZYLSULFANYL5(35DIMETHOXYPHENYL)1H124TRIAZOLE
COC1=CC(=CC(=C1)C2=NC(=NN2)SCC3=CC=CC=C3)OC
COc1cc(OC)cc(c1)c1nnc((nH)1)SCc1ccccc1
InChI=1SC17H17N3O2Sc12114813(915(1014)222)161817(201916)2311126435712h310H11H212H3(H181920)
MFCD05815426
ZINC000005910414
ZINC05910414
ZINC5910414
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