Vitas-M small molecule compound
methyl 4-{(E)-[2-({[4-(4-ethoxyphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}benzoate
Catalog ID
STK103800
SMILES CCOc1ccc(cc1)n1c(SCC(=O)N/N=C/c2ccc(cc2)C(=O)OC)nnc1c1ccccc1
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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 C27H25N5O4S MW 515.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N5O4S/c1-3-36-23-15-13-22(14-16-23)32-25(20-7-5-4-6-8-20)30-31-27(32)37-18-24(33)29-28-17-19-9-11-21(12-10-19)26(34)35-2/h4-17H,3,18H2,1-2H3,(H,29,33)/b28-17+InChIKey
URVCTRLKEJPQHI-OGLMXYFKSA-NSynonyms
351516-40-0(E)methyl4((2(2((4(4ethoxyphenyl)5phenyl4H124triazol3yl)thio)acetyl)hydrazono)methyl)benzoate
351516400
CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NN=CC3=CC=C(C=C3)C(=O)OC)C4=CC=CC=C4
CCOc1ccc(cc1)n1c(SCC(=O)NN=Cc2ccc(cc2)C(=O)OC)nnc1c1ccccc1
InChI=1SC27H25N5O4Sc133623151322(141623)3225(207546820)303127(32)371824(33)2928171991121(121019)26(34)352h417H318H212H3(H2933)b2817+
METHYL4((1E)2(2(4(4ETHOXYPHENYL)5PHENYL(124TRIAZOL3YLTHIO))ACETYLAMINO)2AZAVINYL)BENZOATE
METHYL4((E)((2((4(4ETHOXYPHENYL)5PHENYL124TRIAZOL3YL)SULFANYL)ACETYL)HYDRAZINYLIDENE)METHYL)BENZOATE
METHYL4((E)(2(((4(4ETHOXYPHENYL)5PHENYL4H124TRIAZOL3YL)SULFANYL)ACETYL)HYDRAZINYLIDENE)METHYL)BENZOATE
MFCD01586258
ZINC000002262289
ZINC33351797
Check stock
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Check stock on Vitas-MAvailable files
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