3-[(5-phenylpyrimidin-2-yl)amino]propanenitrile

Systemtic Name: 3-[(5-phenylpyrimidin-2-yl)amino]propanenitrile Openeye Name: 3-[(5-phenylpyrimidin-2-yl)amino]propanenitrile CAS Name: 3-[(5-phenyl-2-pyrimidinyl)amino]propanenitrile IUPAC Name: 3-[(5-phenylpyrimidin-2-yl)amino]propanenitrile Traditional Name: 3-[(5-phenylpyrimidin-2-yl)amino]propionitrile Formula: C13H12N4 MolecularWeight: 224.26118

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12N4/c14-7-4-8-15-13-16-9-12(10-17-13)11-5-2-1-3-6-11/h1-3,5-6,9-10H,4,8H2,(H,15,16,17)