3-[[1-(phenylmethyl)pyrazol-4-yl]methylamino]propanenitrile

Systemtic Name: 3-[[1-(phenylmethyl)pyrazol-4-yl]methylamino]propanenitrile Openeye Name: 3-[(1-benzylpyrazol-4-yl)methylamino]propanenitrile CAS Name: 3-[[1-(phenylmethyl)-4-pyrazolyl]methylamino]propanenitrile IUPAC Name: 3-[(1-benzylpyrazol-4-yl)methylamino]propanenitrile Traditional Name: 3-[(1-benzylpyrazol-4-yl)methylamino]propionitrile Formula: C14H16N4 MolecularWeight: 240.30364

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C=N2)CNCCC#N

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C=N2)CNCCC#N

InChI

InChI=1S/C14H16N4/c15-7-4-8-16-9-14-10-17-18(12-14)11-13-5-2-1-3-6-13/h1-3,5-6,10,12,16H,4,8-9,11H2