Vitas-M small molecule compound
5-hexyl-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK465290
SMILES CCCCCCc1nnc(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 C13H23N3OS MW 269.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H23N3OS/c1-2-3-4-5-8-12-14-15-13(18)16(12)10-11-7-6-9-17-11/h11H,2-10H2,1H3,(H,15,18)InChIKey
WZWHBCNIQILIAS-UHFFFAOYSA-NSynonyms
3hexyl4(oxolan2ylmethyl)1H124triazole5thione
5HEXYL4(OXOLAN2YLMETHYL)124TRIAZOLE3THIOL
5hexyl4(tetrahydrofuran2ylmethyl)4H124triazole3thiol
CCCCCCC1=NNC(=S)N1CC2CCCO2
InChI=1SC13H23N3OSc12345812141513(18)16(12)10117691711h11H210H21H3(H1518)
MFCD06758240
ZINC000016991711
ZINC000016991717
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