Vitas-M small molecule compound

5-(2,4-dichlorophenyl)-4-{[(E)-(3,4,5-trimethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione

Catalog ID
STL147680
SMILES COc1cc(/C=N/n2c(=S)[nH]nc2c2ccc(cc2Cl)Cl)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 C18H16Cl2N4O3S MW 439.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16Cl2N4O3S/c1-25-14-6-10(7-15(26-2)16(14)27-3)9-21-24-17(22-23-18(24)28)12-5-4-11(19)8-13(12)20/h4-9H,1-3H3,(H,23,28)/b21-9+
InChIKey
ZMGAKDNEULERDJ-ZVBGSRNCSA-N
Synonyms
488100-28-3
3(24dichlorophenyl)4((E)(345trimethoxyphenyl)methylideneamino)1H124triazole5thione
488100283
5(24dichlorophenyl)4(((E)(345trimethoxyphenyl)methylidene)amino)24dihydro3H124triazole3thione
COc1cc(C=Nn2c(=S)(nH)nc2c2ccc(cc2Cl)Cl)cc(c1OC)OC
InChI=1SC18H16Cl2N4O3Sc12514610(715(262)16(14)273)9212417(222318(24)28)125411(19)813(12)20h49H13H3(H2328)b219+
MFCD03816294
ZINC000001473657
ZINC12465274

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Available files

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