Vitas-M small molecule compound
4-cyclohexyl-5-{[(2-methylbenzyl)sulfanyl]methyl}-4H-1,2,4-triazole-3-thiol
Catalog ID
STK445616
SMILES Cc1ccccc1CSCc1nnc(n1C1CCCCC1)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 C17H23N3S2 MW 333.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H23N3S2/c1-13-7-5-6-8-14(13)11-22-12-16-18-19-17(21)20(16)15-9-3-2-4-10-15/h5-8,15H,2-4,9-12H2,1H3,(H,19,21)InChIKey
WAWUBYNIEVHPGH-UHFFFAOYSA-NSynonyms
4cyclohexyl3((2methylphenyl)methylsulfanylmethyl)1H124triazole5thione
4cyclohexyl5(((2methylbenzyl)sulfanyl)methyl)4H124triazole3thiol
4CYCLOHEXYL5(((2METHYLPHENYL)METHYLTHIO)METHYL)124TRIAZOLE3THIOL
CC1=CC=CC=C1CSCC2=NNC(=S)N2C3CCCCC3
InChI=1SC17H23N3S2c113756814(13)11221216181917(21)20(16)1593241015h5815H24912H21H3(H1921)
MFCD04057590
ZINC000006789647
ZINC06789647
ZINC6789647
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