Vitas-M small molecule compound
4-{[(E)-(3-bromo-4-methoxyphenyl)methylidene]amino}-5-cyclohexyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK848042
SMILES COc1ccc(cc1Br)/C=N/n1c(=S)[nH]nc1C1CCCCC1
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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 C16H19BrN4OS MW 395.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19BrN4OS/c1-22-14-8-7-11(9-13(14)17)10-18-21-15(19-20-16(21)23)12-5-3-2-4-6-12/h7-10,12H,2-6H2,1H3,(H,20,23)/b18-10+InChIKey
BUIISBPREAAGCM-VCHYOVAHSA-NSynonyms
496775-29-24(((E)(3bromo4methoxyphenyl)methylidene)amino)5cyclohexyl24dihydro3H124triazole3thione
4((E)(3BROMO4METHOXYPHENYL)METHYLIDENEAMINO)3CYCLOHEXYL1H124TRIAZOLE5THIONE
496775292
InChI=1SC16H19BrN4OSc122148711(913(14)17)10182115(192016(21)23)125324612h71012H26H21H3(H2023)b1810+
MFCD07204431
ZINC000005893748
ZINC02300946
ZINC2300946
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