Vitas-M small molecule compound
4-{(E)-[2-({[5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-2,6-dimethoxyphenyl acetate
Catalog ID
STK104539
SMILES COc1cc(/C=N/NC(=O)CSc2nnc(n2CC)c2ccc(cc2)Cl)cc(c1OC(=O)C)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 C23H24ClN5O5S MW 517.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24ClN5O5S/c1-5-29-22(16-6-8-17(24)9-7-16)27-28-23(29)35-13-20(31)26-25-12-15-10-18(32-3)21(34-14(2)30)19(11-15)33-4/h6-12H,5,13H2,1-4H3,(H,26,31)/b25-12+InChIKey
JPPSRTBCONRCAA-BRJLIKDPSA-NSynonyms
(4((E)((2((5(4CHLOROPHENYL)4ETHYL124TRIAZOL3YL)SULFANYL)ACETYL)HYDRAZINYLIDENE)METHYL)26DIMETHOXYPHENYL)ACETATE
(Z)4((2(2((5(4chlorophenyl)4ethyl4H124triazol3yl)thio)acetyl)hydrazono)methyl)26dimethoxyphenylacetate
4((1E)2(2(5(4CHLOROPHENYL)4ETHYL(124TRIAZOL3YLTHIO))ACETYLAMINO)2AZAVINYL)26DIMETHOXYPHENYLACETATE
4((E)(2(((5(4CHLOROPHENYL)4ETHYL4H124TRIAZOL3YL)SULFANYL)ACETYL)HYDRAZINYLIDENE)METHYL)26DIMETHOXYPHENYLACETATE
CCN1C(=NN=C1SCC(=O)NN=CC2=CC(=C(C(=C2)OC)OC(=O)C)OC)C3=CC=C(C=C3)Cl
COc1cc(C=NNC(=O)CSc2nnc(n2CC)c2ccc(cc2)Cl)cc(c1OC(=O)C)OC
InChI=1SC23H24ClN5O5Sc152922(166817(24)9716)272823(29)351320(31)262512151018(323)21(3414(2)30)19(1115)334h612H513H214H3(H2631)b2512+
MFCD03218801
ZINC000001259768
ZINC31879813
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.