Vitas-M small molecule compound
2-amino-4-{4-[(4-fluorophenoxy)methyl]-3-methoxyphenyl}-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile
Catalog ID
STK334381
SMILES COc1cc(ccc1COc1ccc(cc1)F)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 C25H24FN3O2 MW 417.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24FN3O2/c1-30-23-13-16(7-8-17(23)15-31-19-11-9-18(26)10-12-19)24-20-5-3-2-4-6-22(20)29-25(28)21(24)14-27/h7-13H,2-6,15H2,1H3,(H2,28,29)InChIKey
INIXUWATBMTFNY-UHFFFAOYSA-NSynonyms
445031-55-02amino4(4((4fluorophenoxy)methyl)3methoxyphenyl)6789tetrahydro5Hcyclohepta(b)pyridine3carbonitrile
445031550
COC1=C(C=CC(=C1)C2=C(C(=NC3=C2CCCCC3)N)C#N)COC4=CC=C(C=C4)F
InChI=1SC25H24FN3O2c130231316(7817(23)15311911918(26)101219)24205324622(20)2925(28)21(24)1427h713H2615H21H3(H22829)
MFCD02175643
ZINC000018197059
ZINC18197059
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