Vitas-M small molecule compound
methyl 4-{(E)-[2-({[4-(4-chlorophenyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}benzoate
Catalog ID
STK101717
SMILES COC(=O)c1ccc(cc1)/C=N/NC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1ccc(cc1)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 C26H22ClN5O3S MW 520.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22ClN5O3S/c1-17-3-7-19(8-4-17)24-30-31-26(32(24)22-13-11-21(27)12-14-22)36-16-23(33)29-28-15-18-5-9-20(10-6-18)25(34)35-2/h3-15H,16H2,1-2H3,(H,29,33)/b28-15+InChIKey
PFAOUIOXEHEFSS-RWPZCVJISA-NSynonyms
488854-36-0(E)methyl4((2(2((4(4chlorophenyl)5(ptolyl)4H124triazol3yl)thio)acetyl)hydrazono)methyl)benzoate
488854360
CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC(=O)NN=CC4=CC=C(C=C4)C(=O)OC
COC(=O)c1ccc(cc1)C=NNC(=O)CSc1nnc(n1c1ccc(cc1)Cl)c1ccc(cc1)C
InChI=1SC26H22ClN5O3Sc1173719(8417)24303126(32(24)22131121(27)121422)361623(33)292815185920(10618)25(34)352h315H16H212H3(H2933)b2815+
METHYL4((1E)2(2(4(4CHLOROPHENYL)5(4METHYLPHENYL)(124TRIAZOL3YLTHIO))ACETYLAMINO)2AZAVINYL)BENZOATE
METHYL4((E)((2((4(4CHLOROPHENYL)5(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)ACETYL)HYDRAZINYLIDENE)METHYL)BENZOATE
METHYL4((E)(2(((4(4CHLOROPHENYL)5(4METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)ACETYL)HYDRAZINYLIDENE)METHYL)BENZOATE
MFCD03220220
ZINC000001741283
ZINC33342911
Check stock
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Check stock on Vitas-MAvailable files
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