Vitas-M small molecule compound

5-phenyl-4-{[(E)-(2,4,5-trimethoxyphenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol

Catalog ID
STK101550
SMILES COc1cc(OC)c(cc1/C=N/n1c(S)nnc1c1ccccc1)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 C18H18N4O3S MW 370.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N4O3S/c1-23-14-10-16(25-3)15(24-2)9-13(14)11-19-22-17(20-21-18(22)26)12-7-5-4-6-8-12/h4-11H,1-3H3,(H,21,26)/b19-11+
InChIKey
VMZMTPLUJWCQGH-YBFXNURJSA-N
Synonyms
380454-66-0
(E)5phenyl4((245trimethoxybenzylidene)amino)4H124triazole3thiol
380454660
3PHENYL4((E)(245TRIMETHOXYPHENYL)METHYLIDENEAMINO)1H124TRIAZOLE5THIONE
5PHENYL4(((E)(245TRIMETHOXYPHENYL)METHYLIDENE)AMINO)24DIHYDRO3H124TRIAZOLE3THIONE
5PHENYL4(((E)(245TRIMETHOXYPHENYL)METHYLIDENE)AMINO)4H124TRIAZOLE3THIOL
COC1=CC(=C(C=C1C=NN2C(=NNC2=S)C3=CC=CC=C3)OC)OC
InChI=1SC18H18N4O3Sc123141016(253)15(242)913(14)11192217(202118(22)26)127546812h411H13H3(H2126)b1911+
MFCD03288460
ZINC01473756
ZINC1473756

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Available files

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