Vitas-M small molecule compound
2-amino-4-{4-[(2-chlorobenzyl)oxy]-3-methoxyphenyl}-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile
Catalog ID
STL173061
SMILES COc1cc(ccc1OCc1ccccc1Cl)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/c1-31-24-14-17(12-13-23(24)32-16-18-8-6-7-10-21(18)27)25-19-9-4-2-3-5-11-22(19)30-26(29)20(25)15-28/h6-8,10,12-14H,2-5,9,11,16H2,1H3,(H2,29,30)InChIKey
HISGQXCECHFJPC-UHFFFAOYSA-NSynonyms
380647-37-02amino4(4((2chlorobenzyl)oxy)3methoxyphenyl)5678910hexahydrocycloocta(b)pyridine3carbonitrile
2amino4(4((2chlorophenyl)methoxy)3methoxyphenyl)5678910hexahydrocycloocta(b)pyridine3carbonitrile
380647370
COC1=C(C=CC(=C1)C2=C(C(=NC3=C2CCCCCC3)N)C#N)OCC4=CC=CC=C4Cl
InChI=1SC26H26ClN3O2c131241417(121323(24)3216188671021(18)27)2519942351122(19)3026(29)20(25)1528h68101214H2591116H21H3(H22930)
MFCD02175310
ZINC000036020651
ZINC36020651
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