Vitas-M small molecule compound
2-amino-4-{3-methoxy-4-[(4-methoxyphenoxy)methyl]phenyl}-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile
Catalog ID
STK960755
SMILES COc1ccc(cc1)OCc1ccc(cc1OC)c1c2CCCCCc2nc(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 C26H27N3O3 MW 429.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O3/c1-30-19-10-12-20(13-11-19)32-16-18-9-8-17(14-24(18)31-2)25-21-6-4-3-5-7-23(21)29-26(28)22(25)15-27/h8-14H,3-7,16H2,1-2H3,(H2,28,29)InChIKey
KYBXVAZYMIEPBT-UHFFFAOYSA-NSynonyms
445031-77-62amino4(3methoxy4((4methoxyphenoxy)methyl)phenyl)6789tetrahydro5Hcyclohepta(b)pyridine3carbonitrile
445031776
COC1=CC=C(C=C1)OCC2=C(C=C(C=C2)C3=C(C(=NC4=C3CCCCC4)N)C#N)OC
InChI=1SC26H27N3O3c13019101220(131119)3216189817(1424(18)312)25216435723(21)2926(28)22(25)1527h814H3716H212H3(H22829)
MFCD02175833
ZINC000019840991
ZINC19840991
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