2-[3-[cyano(phenyl)methyl]-1,3-diazinan-1-yl]-2-phenyl-ethanenitrile

Systemtic Name: 2-[3-[cyano(phenyl)methyl]-1,3-diazinan-1-yl]-2-phenyl-ethanenitrile Openeye Name: 2-[3-[cyano(phenyl)methyl]hexahydropyrimidin-1-yl]-2-phenyl-acetonitrile CAS Name: 2-[3-[cyano(phenyl)methyl]-1,3-diazinan-1-yl]-2-phenylacetonitrile IUPAC Name: 2-[3-[cyano(phenyl)methyl]-1,3-diazinan-1-yl]-2-phenylacetonitrile Traditional Name: 2-[3-[cyano(phenyl)methyl]hexahydropyrimidin-1-yl]-2-phenyl-acetonitrile Formula: C20H20N4 MolecularWeight: 316.3996

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CN(C1)C(C#N)C2=CC=CC=C2)C(C#N)C3=CC=CC=C3

Isomeric SMILES

C1CN(CN(C1)C(C#N)C2=CC=CC=C2)C(C#N)C3=CC=CC=C3

InChI

InChI=1S/C20H20N4/c21-14-19(17-8-3-1-4-9-17)23-12-7-13-24(16-23)20(15-22)18-10-5-2-6-11-18/h1-6,8-11,19-20H,7,12-13,16H2