Vitas-M small molecule compound
2-amino-4-{5-[(4-chloro-2-methylphenoxy)methyl]-2,4-dimethylphenyl}-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Catalog ID
STK956327
SMILES N#Cc1c(N)nc2c(c1c1cc(COc3ccc(cc3C)Cl)c(cc1C)C)CCCC2
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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 C26H26ClN3O MW 431.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26ClN3O/c1-15-10-16(2)21(12-18(15)14-31-24-9-8-19(27)11-17(24)3)25-20-6-4-5-7-23(20)30-26(29)22(25)13-28/h8-12H,4-7,14H2,1-3H3,(H2,29,30)InChIKey
UGSHPRYSNZEWFT-UHFFFAOYSA-NSynonyms
438228-43-42amino4(5((4chloro2methylphenoxy)methyl)24dimethylphenyl)5678tetrahydroquinoline3carbonitrile
438228434
CC1=CC(=C(C=C1C2=C(C(=NC3=C2CCCC3)N)C#N)COC4=C(C=C(C=C4)Cl)C)C
InChI=1SC26H26ClN3Oc1151016(2)21(1218(15)1431249819(27)1117(24)3)2520645723(20)3026(29)22(25)1328h812H4714H213H3(H22930)
MFCD03075116
ZINC000019841855
ZINC19841855
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