Vitas-M small molecule compound
5-pentyl-3-[(5-sulfanyl-4H-1,2,4-triazol-3-yl)methyl]dihydrofuran-2(3H)-one
Catalog ID
STK529269
SMILES CCCCCC1OC(=O)C(C1)Cc1nnc([nH]1)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 C12H19N3O2S MW 269.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H19N3O2S/c1-2-3-4-5-9-6-8(11(16)17-9)7-10-13-12(18)15-14-10/h8-9H,2-7H2,1H3,(H2,13,14,15,18)InChIKey
DJMODPDIKIGWBX-UHFFFAOYSA-NSynonyms
328009-07-0(3S5S)5PENTYL3((5THIOXO25DIHYDRO1H124TRIAZOL3YL)METHYL)DIHYDROFURAN2(3H)ONE
3((5mercapto4H124triazol3yl)methyl)5pentyldihydrofuran2(3H)one
328009070
5pentyl3((5sulfanyl4H124triazol3yl)methyl)dihydrofuran2(3H)one
5PENTYL3((5SULFANYLIDENE12DIHYDRO124TRIAZOL3YL)METHYL)OXOLAN2ONE
5PENTYL3((5THIOXO25DIHYDRO1H124TRIAZOL3YL)METHYL)DIHYDROFURAN2(3H)ONE
CCCCCC1CC(C(=O)O1)CC2=NC(=S)NN2
CCCCCC1OC(=O)C(C1)Cc1nnc((nH)1)S
InChI=1SC12H19N3O2Sc12345968(11(16)179)7101312(18)151410h89H27H21H3(H213141518)
MFCD00698079
ZINC000005735473
ZINC000005735523
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