Vitas-M small molecule compound
2-{[4,5-bis(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(2,5-dimethoxyphenyl)methylidene]acetohydrazide
Catalog ID
STK102655
SMILES COc1ccc(cc1)n1c(SCC(=O)N/N=C/c2cc(OC)ccc2OC)nnc1c1ccc(cc1)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 C27H27N5O5S MW 533.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N5O5S/c1-34-21-9-5-18(6-10-21)26-30-31-27(32(26)20-7-11-22(35-2)12-8-20)38-17-25(33)29-28-16-19-15-23(36-3)13-14-24(19)37-4/h5-16H,17H2,1-4H3,(H,29,33)/b28-16+InChIKey
SEPPFSUDHFLPDD-LQKURTRISA-NSynonyms
406202-95-7(E)2((45bis(4methoxyphenyl)4H124triazol3yl)thio)N(25dimethoxybenzylidene)acetohydrazide
2((45BIS(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)N((E)(25DIMETHOXYPHENYL)METHYLIDENEAMINO)ACETAMIDE
2((45BIS(4METHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)N((E)(25DIMETHOXYPHENYL)METHYLIDENE)ACETOHYDRAZIDE
406202957
COC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)OC)SCC(=O)NN=CC4=C(C=CC(=C4)OC)OC
COc1ccc(cc1)n1c(SCC(=O)NN=Cc2cc(OC)ccc2OC)nnc1c1ccc(cc1)OC
InChI=1SC27H27N5O5Sc134219518(61021)26303127(32(26)2071122(352)12820)381725(33)292816191523(363)131424(19)374h516H17H214H3(H2933)b2816+
MFCD03220739
ZINC000001253280
ZINC101505820
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