Vitas-M small molecule compound

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

Catalog ID
STK007435
SMILES COc1ccccc1/C=N/NC(=O)CSc1nnc(n1C1CCCCC1)c1ccc(cc1)Cl

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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 C24H26ClN5O2S MW 484.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26ClN5O2S/c1-32-21-10-6-5-7-18(21)15-26-27-22(31)16-33-24-29-28-23(17-11-13-19(25)14-12-17)30(24)20-8-3-2-4-9-20/h5-7,10-15,20H,2-4,8-9,16H2,1H3,(H,27,31)/b26-15+
InChIKey
QBKZHPJFTGPKKF-CVKSISIWSA-N
Synonyms
487026-17-5
(E)2((5(4chlorophenyl)4cyclohexyl4H124triazol3yl)thio)N(2methoxybenzylidene)acetohydrazide
2((5(4chlorophenyl)4cyclohexyl124triazol3yl)sulfanyl)N((E)(2methoxyphenyl)methylideneamino)acetamide
2((5(4CHLOROPHENYL)4CYCLOHEXYL4H124TRIAZOL3YL)SULFANYL)N((E)(2METHOXYPHENYL)METHYLIDENE)ACETOHYDRAZIDE
487026175
COC1=CC=CC=C1C=NNC(=O)CSC2=NN=C(N2C3CCCCC3)C4=CC=C(C=C4)Cl
COc1ccccc1C=NNC(=O)CSc1nnc(n1C1CCCCC1)c1ccc(cc1)Cl
InChI=1SC24H26ClN5O2Sc132211065718(21)15262722(31)163324292823(17111319(25)141217)30(24)208324920h57101520H248916H21H3(H2731)b2615+
MFCD03221018
N((1E)2(2METHOXYPHENYL)1AZAVINYL)2(5(4CHLOROPHENYL)4CYCLOHEXYL(124TRIAZOL3YLTHIO))ACETAMIDE
STK007435
ZINC000009333951
ZINC101381808

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.