Vitas-M small molecule compound
2-{[4-(4-methylphenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(3,4,5-trimethoxyphenyl)methylidene]acetohydrazide
Catalog ID
STK056067
SMILES COc1cc(/C=N/NC(=O)CSc2nnc(n2c2ccc(cc2)C)c2ccccc2)cc(c1OC)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 C27H27N5O4S MW 517.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N5O4S/c1-18-10-12-21(13-11-18)32-26(20-8-6-5-7-9-20)30-31-27(32)37-17-24(33)29-28-16-19-14-22(34-2)25(36-4)23(15-19)35-3/h5-16H,17H2,1-4H3,(H,29,33)/b28-16+InChIKey
KLIAGTDQFASWIN-LQKURTRISA-NSynonyms
314071-65-3(E)2((5phenyl4(ptolyl)4H124triazol3yl)thio)N(345trimethoxybenzylidene)acetohydrazide
2((4(4methylphenyl)5phenyl124triazol3yl)sulfanyl)N((E)(345trimethoxyphenyl)methylideneamino)acetamide
2((4(4METHYLPHENYL)5PHENYL4H124TRIAZOL3YL)SULFANYL)N((E)(345TRIMETHOXYPHENYL)METHYLIDENE)ACETOHYDRAZIDE
314071653
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NN=CC3=CC(=C(C(=C3)OC)OC)OC)C4=CC=CC=C4
COc1cc(C=NNC(=O)CSc2nnc(n2c2ccc(cc2)C)c2ccccc2)cc(c1OC)OC
InChI=1SC27H27N5O4Sc118101221(131118)3226(208657920)303127(32)371724(33)292816191422(342)25(364)23(1519)353h516H17H214H3(H2933)b2816+
MFCD01916104
N((1E)2(345TRIMETHOXYPHENYL)1AZAVINYL)2(4(4METHYLPHENYL)5PHENYL(124TRIAZOL3YLTHIO))ACETAMIDE
STK056067
ZINC000001239304
ZINC33327053
Check stock
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Check stock on Vitas-MAvailable files
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