Vitas-M small molecule compound

1-(4-ethoxyphenyl)-3-(4-hydroxy-6-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl}pyrimidin-2-yl)guanidine

Catalog ID
STL041555
SMILES CCOc1ccc(cc1)NC(=N)Nc1nc(O)cc(n1)CSc1nnnn1c1ccccc1

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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 C21H21N9O2S MW 463.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N9O2S/c1-2-32-17-10-8-14(9-11-17)23-19(22)26-20-24-15(12-18(31)25-20)13-33-21-27-28-29-30(21)16-6-4-3-5-7-16/h3-12H,2,13H2,1H3,(H4,22,23,24,25,26,31)
InChIKey
BAEDIIOYMWFLSE-UHFFFAOYSA-N
Synonyms
669744-97-2
1(4ethoxyphenyl)3(4hydroxy6(((1phenyl1Htetrazol5yl)sulfanyl)methyl)pyrimidin2yl)guanidine
669744972
MFCD05727258
ZINC000009245403

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.