Vitas-M small molecule compound
2-amino-4-{4-[(3-chlorobenzyl)oxy]-3-methoxyphenyl}-5,6,7,8,9,10-hexahydrocycloocta[b]pyridine-3-carbonitrile
Catalog ID
STL173058
SMILES COc1cc(ccc1OCc1cccc(c1)Cl)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/c1-31-24-14-18(11-12-23(24)32-16-17-7-6-8-19(27)13-17)25-20-9-4-2-3-5-10-22(20)30-26(29)21(25)15-28/h6-8,11-14H,2-5,9-10,16H2,1H3,(H2,29,30)InChIKey
QEAYPERBFWMVJB-UHFFFAOYSA-NSynonyms
397874-97-42amino4(4((3chlorobenzyl)oxy)3methoxyphenyl)5678910hexahydrocycloocta(b)pyridine3carbonitrile
2amino4(4((3chlorophenyl)methoxy)3methoxyphenyl)5678910hexahydrocycloocta(b)pyridine3carbonitrile
397874974
COC1=C(C=CC(=C1)C2=C(C(=NC3=C2CCCCCC3)N)C#N)OCC4=CC(=CC=C4)Cl
InChI=1SC26H26ClN3O2c131241418(111223(24)32161776819(27)1317)2520942351022(20)3026(29)21(25)1528h681114H2591016H21H3(H22930)
MFCD02175333
ZINC000036020650
ZINC36020650
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