2-[3-[[1-(1,5-dimethylpyrazol-4-yl)ethylamino]methyl]phenoxy]ethanenitrile

Systemtic Name: 2-[3-[[1-(1,5-dimethylpyrazol-4-yl)ethylamino]methyl]phenoxy]ethanenitrile Openeye Name: 2-[3-[[1-(1,5-dimethylpyrazol-4-yl)ethylamino]methyl]phenoxy]acetonitrile CAS Name: 2-[3-[[1-(1,5-dimethyl-4-pyrazolyl)ethylamino]methyl]phenoxy]acetonitrile IUPAC Name: 2-[3-[[1-(1,5-dimethylpyrazol-4-yl)ethylamino]methyl]phenoxy]acetonitrile Traditional Name: 2-[3-[[1-(1,5-dimethylpyrazol-4-yl)ethylamino]methyl]phenoxy]acetonitrile Formula: C16H20N4O MolecularWeight: 284.3562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)C(C)NCC2=CC(=CC=C2)OCC#N

Isomeric SMILES

CC1=C(C=NN1C)C(C)NCC2=CC(=CC=C2)OCC#N

InChI

InChI=1S/C16H20N4O/c1-12(16-11-19-20(3)13(16)2)18-10-14-5-4-6-15(9-14)21-8-7-17/h4-6,9,11-12,18H,8,10H2,1-3H3