Vitas-M small molecule compound
4-ethyl-5-[4-(propan-2-yl)phenyl]-4H-1,2,4-triazole-3-thiol
Catalog ID
STK446269
SMILES CCn1c(S)nnc1c1ccc(cc1)C(C)C
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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 C13H17N3S MW 247.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17N3S/c1-4-16-12(14-15-13(16)17)11-7-5-10(6-8-11)9(2)3/h5-9H,4H2,1-3H3,(H,15,17)InChIKey
DNADHHDEAPRXAM-UHFFFAOYSA-NSynonyms
669729-27-54ETHYL3(4PROPAN2YLPHENYL)1H124TRIAZOLE5THIONE
4ETHYL5(4(METHYLETHYL)PHENYL)124TRIAZOLE3THIOL
4ethyl5(4(propan2yl)phenyl)4H124triazole3thiol
4ETHYL5(4ISOPROPYLPHENYL)124TRIAZOLE3THIOL
4ETHYL5(4ISOPROPYLPHENYL)4H124TRIAZOLE3THIOL
669729275
CCN1C(=NNC1=S)C2=CC=C(C=C2)C(C)C
InChI=1SC13H17N3Sc141612(141513(16)17)117510(6811)9(2)3h59H4H213H3(H1517)
MFCD04058802
ZINC000002526669
ZINC02526669
ZINC2526669
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