Vitas-M small molecule compound

4-{(E)-[2-({[5-(4-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-2-methoxyphenyl acetate

Catalog ID
STL362265
SMILES COc1cc(/C=N/NC(=O)CSc2nnc(n2c2ccccc2)c2ccc(cc2)Cl)ccc1OC(=O)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 C26H22ClN5O4S MW 536.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22ClN5O4S/c1-17(33)36-22-13-8-18(14-23(22)35-2)15-28-29-24(34)16-37-26-31-30-25(19-9-11-20(27)12-10-19)32(26)21-6-4-3-5-7-21/h3-15H,16H2,1-2H3,(H,29,34)/b28-15+
InChIKey
JEGMUSASYDVZKP-RWPZCVJISA-N
Synonyms
315217-61-9
(4((E)((2((5(4CHLOROPHENYL)4PHENYL124TRIAZOL3YL)SULFANYL)ACETYL)HYDRAZINYLIDENE)METHYL)2METHOXYPHENYL)ACETATE
(E)4((2(2((5(4chlorophenyl)4phenyl4H124triazol3yl)thio)acetyl)hydrazono)methyl)2methoxyphenylacetate
315217619
4((1E)2(2(5(4CHLOROPHENYL)4PHENYL(124TRIAZOL3YLTHIO))ACETYLAMINO)2AZAVINYL)2METHOXYPHENYLACETATE
4((E)(2(((5(4chlorophenyl)4phenyl4H124triazol3yl)sulfanyl)acetyl)hydrazinylidene)methyl)2methoxyphenylacetate
CC(=O)OC1=C(C=C(C=C1)C=NNC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=C(C=C4)Cl)OC
InChI=1SC26H22ClN5O4Sc117(33)362213818(1423(22)352)15282924(34)163726313025(1991120(27)121019)32(26)216435721h315H16H212H3(H2934)b2815+
MFCD02076833
ZINC000002266219
ZINC100300845

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Available files

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