Vitas-M small molecule compound

2-{[5-(4-chlorophenyl)-4-cyclohexyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2,4,5-trimethoxyphenyl)methylidene]acetohydrazide

Catalog ID
STK037241
SMILES COc1cc(OC)c(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 C26H30ClN5O4S MW 544.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30ClN5O4S/c1-34-21-14-23(36-3)22(35-2)13-18(21)15-28-29-24(33)16-37-26-31-30-25(17-9-11-19(27)12-10-17)32(26)20-7-5-4-6-8-20/h9-15,20H,4-8,16H2,1-3H3,(H,29,33)/b28-15+
InChIKey
GOKQEPXAOWYZSZ-RWPZCVJISA-N
Synonyms
488095-71-2
(E)2((5(4chlorophenyl)4cyclohexyl4H124triazol3yl)thio)N(245trimethoxybenzylidene)acetohydrazide
2((5(4chlorophenyl)4cyclohexyl124triazol3yl)sulfanyl)N((E)(245trimethoxyphenyl)methylideneamino)acetamide
2((5(4CHLOROPHENYL)4CYCLOHEXYL4H124TRIAZOL3YL)SULFANYL)N((E)(245TRIMETHOXYPHENYL)METHYLIDENE)ACETOHYDRAZIDE
488095712
COC1=CC(=C(C=C1C=NNC(=O)CSC2=NN=C(N2C3CCCCC3)C4=CC=C(C=C4)Cl)OC)OC
InChI=1SC26H30ClN5O4Sc134211423(363)22(352)1318(21)15282924(33)163726313025(1791119(27)121017)32(26)207546820h91520H4816H213H3(H2933)b2815+
MFCD03221047
N((1E)2(245TRIMETHOXYPHENYL)1AZAVINYL)2(5(4CHLOROPHENYL)4CYCLOHEXYL(124TRIAZOL3YLTHIO))ACETAMIDE
STK037241
ZINC000100834057
ZINC101423112

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Available files

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