Vitas-M small molecule compound
2-[(2-chlorobenzyl)sulfanyl]-9-(4-hydroxy-3-methoxyphenyl)-5,6,7,9-tetrahydro[1,2,4]triazolo[5,1-b]quinazolin-8-ol
Catalog ID
STK597673
SMILES COc1cc(ccc1O)C1C2=C(O)CCCC2=Nc2n1nc(n2)SCc1ccccc1Cl
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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 C23H21ClN4O3S MW 468.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21ClN4O3S/c1-31-19-11-13(9-10-17(19)29)21-20-16(7-4-8-18(20)30)25-22-26-23(27-28(21)22)32-12-14-5-2-3-6-15(14)24/h2-3,5-6,9-11,21,29-30H,4,7-8,12H2,1H3InChIKey
SPIYXEAXRPEZKQ-UHFFFAOYSA-NSynonyms
2((2chlorobenzyl)sulfanyl)9(4hydroxy3methoxyphenyl)5679tetrahydro(124)triazolo(51b)quinazolin8ol
MFCD08730955
ZINC000102680005
ZINC000102680007
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