IUPAC: 2-[4-methyl-5-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylamino]-1,2,4-triazol-3-yl]acetonitrile

SMILES: Cn1c(CC#N)nnc1NCCCOc1cccc(CN2CCCCC2)c1

Canonical SMILES: CN1C(=NN=C1NCCCOC2=CC=CC(=C2)CN3CCCCC3)CC#N

分子式: C20H28N6O

分子量: 368.50

InChIKey: IRSHVZGQWBOQMP-UHFFFAOYSA-N

InChI:

InChI=1S/C20H28N6O/c1-25-19(9-10-21)23-24-20(25)22-11-6-14-27-18-8-5-7-17(15-18)16-26-12-3-2-4-13-26/h5,7-8,15H,2-4,6,9,11-14,16H2,1H3,(H,22,24)

同義語

SCHEMBL10970857

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