2-[3-[(1-tert-butylpyrazol-4-yl)methylamino]phenoxy]ethanenitrile

Systemtic Name: 2-[3-[(1-tert-butylpyrazol-4-yl)methylamino]phenoxy]ethanenitrile Openeye Name: 2-[3-[(1-tert-butylpyrazol-4-yl)methylamino]phenoxy]acetonitrile CAS Name: 2-[3-[(1-tert-butyl-4-pyrazolyl)methylamino]phenoxy]acetonitrile IUPAC Name: 2-[3-[(1-tert-butylpyrazol-4-yl)methylamino]phenoxy]acetonitrile Traditional Name: 2-[3-[(1-tert-butylpyrazol-4-yl)methylamino]phenoxy]acetonitrile Formula: C16H20N4O MolecularWeight: 284.3562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=C(C=N1)CNC2=CC(=CC=C2)OCC#N

Isomeric SMILES

CC(C)(C)N1C=C(C=N1)CNC2=CC(=CC=C2)OCC#N

InChI

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