Vitas-M small molecule compound

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

Catalog ID
STK083584
SMILES COc1ccc(cc1)/C(=N\NC(=O)CSc1nnc(n1C1CCCCC1)c1ccc(cc1)Cl)/C

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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 C25H28ClN5O2S MW 498.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28ClN5O2S/c1-17(18-10-14-22(33-2)15-11-18)27-28-23(32)16-34-25-30-29-24(19-8-12-20(26)13-9-19)31(25)21-6-4-3-5-7-21/h8-15,21H,3-7,16H2,1-2H3,(H,28,32)/b27-17-
InChIKey
MXSOKYSPFHBNCZ-PKAZHMFMSA-N
Synonyms
488803-08-3
(Z)2((5(4chlorophenyl)4cyclohexyl4H124triazol3yl)thio)N(1(4methoxyphenyl)ethylidene)acetohydrazide
2((5(4CHLOROPHENYL)4CYCLOHEXYL124TRIAZOL3YL)SULFANYL)N((Z)1(4METHOXYPHENYL)ETHYLIDENEAMINO)ACETAMIDE
2((5(4CHLOROPHENYL)4CYCLOHEXYL4H124TRIAZOL3YL)SULFANYL)N((1Z)1(4METHOXYPHENYL)ETHYLIDENE)ACETOHYDRAZIDE
488803083
CC(=NNC(=O)CSC1=NN=C(N1C2CCCCC2)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)OC
InChI=1SC25H28ClN5O2Sc117(18101422(332)151118)272823(32)163425302924(1981220(26)13919)31(25)216435721h81521H3716H212H3(H2832)b2717
MFCD03221007
N((1Z)2(4METHOXYPHENYL)1AZAPROP1ENYL)2(5(4CHLOROPHENYL)4CYCLOHEXYL(124TRIAZOL3YLTHIO))ACETAMIDE
STK083584
ZINC000009045958
ZINC33918501

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Available files

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