Vitas-M small molecule compound
2-{[5-(4-chlorophenyl)-4-cyclohexyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2,5-dimethoxyphenyl)methylidene]acetohydrazide
Catalog ID
STK073637
SMILES COc1ccc(cc1/C=N/NC(=O)CSc1nnc(n1C1CCCCC1)c1ccc(cc1)Cl)OC
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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 C25H28ClN5O3S MW 514.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28ClN5O3S/c1-33-21-12-13-22(34-2)18(14-21)15-27-28-23(32)16-35-25-30-29-24(17-8-10-19(26)11-9-17)31(25)20-6-4-3-5-7-20/h8-15,20H,3-7,16H2,1-2H3,(H,28,32)/b27-15+InChIKey
VQAISDSPMBZENK-JFLMPSFJSA-NSynonyms
496796-98-6(E)2((5(4chlorophenyl)4cyclohexyl4H124triazol3yl)thio)N(25dimethoxybenzylidene)acetohydrazide
2((5(4chlorophenyl)4cyclohexyl124triazol3yl)sulfanyl)N((E)(25dimethoxyphenyl)methylideneamino)acetamide
2((5(4CHLOROPHENYL)4CYCLOHEXYL4H124TRIAZOL3YL)SULFANYL)N((E)(25DIMETHOXYPHENYL)METHYLIDENE)ACETOHYDRAZIDE
496796986
COC1=CC(=C(C=C1)OC)C=NNC(=O)CSC2=NN=C(N2C3CCCCC3)C4=CC=C(C=C4)Cl
COc1ccc(cc1C=NNC(=O)CSc1nnc(n1C1CCCCC1)c1ccc(cc1)Cl)OC
InChI=1SC25H28ClN5O3Sc13321121322(342)18(1421)15272823(32)163525302924(1781019(26)11917)31(25)206435720h81520H3716H212H3(H2832)b2715+
MFCD03221060
N((1E)2(25DIMETHOXYPHENYL)1AZAVINYL)2(5(4CHLOROPHENYL)4CYCLOHEXYL(124TRIAZOL3YLTHIO))ACETAMIDE
STK073637
ZINC000009302112
ZINC33712929
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.