Vitas-M small molecule compound
2-amino-4-{3-[(2-chlorophenoxy)methyl]-4-methoxyphenyl}-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile
Catalog ID
STK961320
SMILES COc1ccc(cc1COc1ccccc1Cl)c1c2CCCCCCc2nc(c1C#N)N
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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 C26H26ClN3O2 MW 447.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26ClN3O2/c1-31-23-13-12-17(14-18(23)16-32-24-11-7-6-9-21(24)27)25-19-8-4-2-3-5-10-22(19)30-26(29)20(25)15-28/h6-7,9,11-14H,2-5,8,10,16H2,1H3,(H2,29,30)InChIKey
QHJRUFUZVRTNLK-UHFFFAOYSA-NSynonyms
445034-68-42amino4(3((2chlorophenoxy)methyl)4methoxyphenyl)5678910hexahydrocycloocta(b)pyridine3carbonitrile
445034684
COC1=C(C=C(C=C1)C2=C(C(=NC3=C2CCCCCC3)N)C#N)COC4=CC=CC=C4Cl
InChI=1SC26H26ClN3O2c13123131217(1418(23)1632241176921(24)27)2519842351022(19)3026(29)20(25)1528h6791114H2581016H21H3(H22930)
MFCD02373651
ZINC000036046213
ZINC36046213
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