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

Systemtic Name: 2-[3-[cyano(phenyl)methyl]-2-phenyl-1,3-diazinan-1-yl]-2-phenyl-ethanenitrile Openeye Name: 2-[3-[cyano(phenyl)methyl]-2-phenyl-hexahydropyrimidin-1-yl]-2-phenyl-acetonitrile CAS Name: 2-[3-[cyano(phenyl)methyl]-2-phenyl-1,3-diazinan-1-yl]-2-phenylacetonitrile IUPAC Name: 2-[3-[cyano(phenyl)methyl]-2-phenyl-1,3-diazinan-1-yl]-2-phenylacetonitrile Traditional Name: 2-[3-[cyano(phenyl)methyl]-2-phenyl-hexahydropyrimidin-1-yl]-2-phenyl-acetonitrile Formula: C26H24N4 MolecularWeight: 392.49556

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(N(C1)C(C#N)C2=CC=CC=C2)C3=CC=CC=C3)C(C#N)C4=CC=CC=C4

Isomeric SMILES

C1CN(C(N(C1)C(C#N)C2=CC=CC=C2)C3=CC=CC=C3)C(C#N)C4=CC=CC=C4

InChI

InChI=1S/C26H24N4/c27-19-24(21-11-4-1-5-12-21)29-17-10-18-30(26(29)23-15-8-3-9-16-23)25(20-28)22-13-6-2-7-14-22/h1-9,11-16,24-26H,10,17-18H2