Vitas-M small molecule compound

methyl 1,6,8-triphenyl-4-thia-1,2,6,7-tetraazaspiro[4.5]deca-2,7,9-triene-3-carboxylate

Catalog ID
STL006543
SMILES COC(=O)C1=NN(C2(S1)C=CC(=NN2c1ccccc1)c1ccccc1)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 C25H20N4O2S MW 440.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20N4O2S/c1-31-24(30)23-27-29(21-15-9-4-10-16-21)25(32-23)18-17-22(19-11-5-2-6-12-19)26-28(25)20-13-7-3-8-14-20/h2-18H,1H3
InChIKey
VCGBRSLSRLFBJT-UHFFFAOYSA-N
Synonyms
668443-20-7
668443207
COC(=O)C1=NN(C2(S1)C=CC(=NN2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5
InChI=1SC25H20N4O2Sc13124(30)232729(211594101621)25(3223)181722(19115261219)2628(25)20137381420h218H1H3
methyl168triphenyl4thia1267tetraazaspiro(45)deca279triene3carboxylate
methyl4810triphenyl1thia34910tetrazaspiro(45)deca268triene2carboxylate
MFCD03672585
ZINC000009075695
ZINC000013659392

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Available files

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