Vitas-M small molecule compound

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

Catalog ID
STK597927
SMILES COc1ccc(c(c1)/C=N/n1c(=S)[nH]nc1c1cc(OC)c(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 C20H22N4O5S MW 430.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O5S/c1-25-14-6-7-15(26-2)13(8-14)11-21-24-19(22-23-20(24)30)12-9-16(27-3)18(29-5)17(10-12)28-4/h6-11H,1-5H3,(H,23,30)/b21-11+
InChIKey
FMXPERXXIMEZLW-SRZZPIQSSA-N
Synonyms
1410988-16-7
1410988167
4(((E)(25dimethoxyphenyl)methylidene)amino)5(345trimethoxyphenyl)24dihydro3H124triazole3thione
4((1E)2(25DIMETHOXYPHENYL)1AZAVINYL)5(345TRIMETHOXYPHENYL)124TRIAZOLE3THIOL
4((E)(25DIMETHOXYPHENYL)METHYLIDENEAMINO)3(345TRIMETHOXYPHENYL)1H124TRIAZOLE5THIONE
COC1=CC(=C(C=C1)OC)C=NN2C(=NNC2=S)C3=CC(=C(C(=C3)OC)OC)OC
COc1ccc(c(c1)C=Nn1c(=S)(nH)nc1c1cc(OC)c(c(c1)OC)OC)OC
InChI=1SC20H22N4O5Sc125146715(262)13(814)11212419(222320(24)30)12916(273)18(295)17(1012)284h611H15H3(H2330)b2111+
MFCD07197362
ZINC000009329501
ZINC2234172

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Available files

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