Vitas-M small molecule compound

2-{[5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(1E,2Z)-2-chloro-3-phenylprop-2-en-1-ylidene]acetohydrazide

Catalog ID
STK106176
SMILES CCn1c(SCC(=O)N/N=C/C(=C/c2ccccc2)/Cl)nnc1c1ccc(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 C21H19Cl2N5OS MW 460.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19Cl2N5OS/c1-2-28-20(16-8-10-17(22)11-9-16)26-27-21(28)30-14-19(29)25-24-13-18(23)12-15-6-4-3-5-7-15/h3-13H,2,14H2,1H3,(H,25,29)/b18-12-,24-13+
InChIKey
WHTXCPVCPYUJRY-SJVSIACESA-N
Synonyms
329904-06-5
(E)N((Z)2chloro3phenylallylidene)2((5(4chlorophenyl)4ethyl4H124triazol3yl)thio)acetohydrazide
2((5(4CHLOROPHENYL)4ETHYL124TRIAZOL3YL)SULFANYL)N((E)((Z)2CHLORO3PHENYLPROP2ENYLIDENE)AMINO)ACETAMIDE
2((5(4CHLOROPHENYL)4ETHYL4H124TRIAZOL3YL)SULFANYL)N((1E2Z)2CHLORO3PHENYLPROP2EN1YLIDENE)ACETOHYDRAZIDE
329904065
CCN1C(=NN=C1SCC(=O)NN=CC(=CC2=CC=CC=C2)Cl)C3=CC=C(C=C3)Cl
CCn1c(SCC(=O)NN=CC(=Cc2ccccc2)Cl)nnc1c1ccc(cc1)Cl
InChI=1SC21H19Cl2N5OSc122820(1681017(22)11916)262721(28)301419(29)25241318(23)12156435715h313H214H21H3(H2529)b18122413+
MFCD02709987
N((3Z1E)3CHLORO4PHENYL1AZABUTA13DIENYL)2(5(4CHLOROPHENYL)4ETHYL(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000001825367
ZINC35057234

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Available files

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