2-(1-phenylpyrazol-4-yl)-2-(propan-2-ylamino)ethanenitrile

Systemtic Name: 2-(1-phenylpyrazol-4-yl)-2-(propan-2-ylamino)ethanenitrile Openeye Name: 2-(isopropylamino)-2-(1-phenylpyrazol-4-yl)acetonitrile CAS Name: 2-(1-phenyl-4-pyrazolyl)-2-(propan-2-ylamino)acetonitrile IUPAC Name: 2-(1-phenylpyrazol-4-yl)-2-(propan-2-ylamino)acetonitrile Traditional Name: 2-(isopropylamino)-2-(1-phenylpyrazol-4-yl)acetonitrile Formula: C14H16N4 MolecularWeight: 240.30364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(C#N)C1=CN(N=C1)C2=CC=CC=C2

Isomeric SMILES

CC(C)NC(C#N)C1=CN(N=C1)C2=CC=CC=C2

InChI

InChI=1S/C14H16N4/c1-11(2)17-14(8-15)12-9-16-18(10-12)13-6-4-3-5-7-13/h3-7,9-11,14,17H,1-2H3