2-[3-[(1-methyl-3-propan-2-yl-pyrazol-4-yl)methylamino]phenoxy]ethanenitrile

Systemtic Name: 2-[3-[(1-methyl-3-propan-2-yl-pyrazol-4-yl)methylamino]phenoxy]ethanenitrile Openeye Name: 2-[3-[(3-isopropyl-1-methyl-pyrazol-4-yl)methylamino]phenoxy]acetonitrile CAS Name: 2-[3-[(1-methyl-3-propan-2-yl-4-pyrazolyl)methylamino]phenoxy]acetonitrile IUPAC Name: 2-[3-[(1-methyl-3-propan-2-ylpyrazol-4-yl)methylamino]phenoxy]acetonitrile Traditional Name: 2-[3-[(3-isopropyl-1-methyl-pyrazol-4-yl)methylamino]phenoxy]acetonitrile Formula: C16H20N4O MolecularWeight: 284.3562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN(C=C1CNC2=CC(=CC=C2)OCC#N)C

Isomeric SMILES

CC(C)C1=NN(C=C1CNC2=CC(=CC=C2)OCC#N)C

InChI

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