Vitas-M small molecule compound

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

Catalog ID
STK580383
SMILES COc1cc(cc(c1OC)OC)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)C

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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 C19H20N4O3S MW 384.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N4O3S/c1-12-5-7-13(8-6-12)11-20-23-18(21-22-19(23)27)14-9-15(24-2)17(26-4)16(10-14)25-3/h5-11H,1-4H3,(H,22,27)/b20-11+
InChIKey
BGIDECJWJQAUNJ-RGVLZGJSSA-N
Synonyms
500272-40-2
4(((E)(4methylphenyl)methylidene)amino)5(345trimethoxyphenyl)24dihydro3H124triazole3thione
4((E)(4METHYLPHENYL)METHYLIDENEAMINO)3(345TRIMETHOXYPHENYL)1H124TRIAZOLE5THIONE
500272402
CC1=CC=C(C=C1)C=NN2C(=NNC2=S)C3=CC(=C(C(=C3)OC)OC)OC
COc1cc(cc(c1OC)OC)c1n(nH)c(=S)n1N=Cc1ccc(cc1)C
InChI=1SC19H20N4O3Sc1125713(8612)11202318(212219(23)27)14915(242)17(264)16(1014)253h511H14H3(H2227)b2011+
MFCD07197453
ZINC000006009096
ZINC1478657

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Available files

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