Vitas-M small molecule compound

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

Catalog ID
STL051836
SMILES Sc1nnc(n1/N=C/c1cccc(c1)Oc1ccccc1)c1n[nH]c(c1)c1ccccc1

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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 C24H18N6OS MW 438.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18N6OS/c32-24-29-28-23(22-15-21(26-27-22)18-9-3-1-4-10-18)30(24)25-16-17-8-7-13-20(14-17)31-19-11-5-2-6-12-19/h1-16H,(H,26,27)(H,29,32)/b25-16+
InChIKey
UNVIJUINKSQFCK-PCLIKHOPSA-N
Synonyms
850743-20-3
(E)4((3phenoxybenzylidene)amino)5(3phenyl1Hpyrazol5yl)4H124triazole3thiol
4(((E)(3phenoxyphenyl)methylidene)amino)5(5phenyl1Hpyrazol3yl)4H124triazole3thiol
4((1E)2(3PHENOXYPHENYL)1AZAVINYL)5(3PHENYLPYRAZOL5YL)124TRIAZOLE3THIOL
4((E)(3PHENOXYPHENYL)METHYLIDENEAMINO)3(3PHENYL1HPYRAZOL5YL)1H124TRIAZOLE5THIONE
850743203
C1=CC=C(C=C1)C2=NNC(=C2)C3=NNC(=S)N3N=CC4=CC(=CC=C4)OC5=CC=CC=C5
InChI=1SC24H18N6OSc3224292823(221521(262722)1893141018)30(24)251617871320(1417)3119115261219h116H(H2627)(H2932)b2516+
MFCD05730079
Sc1nnc(n1N=Cc1cccc(c1)Oc1ccccc1)c1(nH)nc(c1)c1ccccc1
Sc1nnc(n1N=Cc1cccc(c1)Oc1ccccc1)c1n(nH)c(c1)c1ccccc1
ZINC000009375057
ZINC33345703

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Available files

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