Vitas-M small molecule compound

N'-[(E)-(2,5-dimethoxyphenyl)methylidene]-2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide

Catalog ID
STK090488
SMILES COc1ccc(c(c1)/C=N/NC(=O)CSc1nnc(n1c1ccccc1)c1ccc(c(c1)OC)OC)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/c1-34-21-11-13-22(35-2)19(14-21)16-28-29-25(33)17-38-27-31-30-26(32(27)20-8-6-5-7-9-20)18-10-12-23(36-3)24(15-18)37-4/h5-16H,17H2,1-4H3,(H,29,33)/b28-16+
InChIKey
UZQFBFWVPDTMBG-LQKURTRISA-N
Synonyms

(Z)N(25dimethoxybenzylidene)2((5(34dimethoxyphenyl)4phenyl4H124triazol3yl)thio)acetohydrazide
COC1=CC(=C(C=C1)OC)C=NNC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC(=C(C=C4)OC)OC
COc1ccc(c(c1)C=NNC(=O)CSc1nnc(n1c1ccccc1)c1ccc(c(c1)OC)OC)OC
InChI=1SC27H27N5O5Sc13421111322(352)19(1421)16282925(33)173827313026(32(27)208657920)18101223(363)24(1518)374h516H17H214H3(H2933)b2816+
MFCD01841586
N((1E)2(25DIMETHOXYPHENYL)1AZAVINYL)2(5(34DIMETHOXYPHENYL)4PHENYL(124TRIAZOL3YLTHIO))ACETAMIDE
N((E)(25DIMETHOXYPHENYL)METHYLIDENE)2((5(34DIMETHOXYPHENYL)4PHENYL4H124TRIAZOL3YL)SULFANYL)ACETOHYDRAZIDE
N((E)(25DIMETHOXYPHENYL)METHYLIDENEAMINO)2((5(34DIMETHOXYPHENYL)4PHENYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
STK090488
ZINC000001254864
ZINC100842620

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Available files

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