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

Systemtic Name: (2R)-2-[3-[(S)-cyano(phenyl)methyl]-2-(2-hydroxyphenyl)-1,3-diazinan-1-yl]-2-phenyl-ethanenitrile Openeye Name: (2R)-2-[3-[(S)-cyano(phenyl)methyl]-2-(2-hydroxyphenyl)hexahydropyrimidin-1-yl]-2-phenyl-acetonitrile CAS Name: (2R)-2-[3-[(S)-cyano(phenyl)methyl]-2-(2-hydroxyphenyl)-1,3-diazinan-1-yl]-2-phenylacetonitrile IUPAC Name: (2R)-2-[3-[(S)-cyano(phenyl)methyl]-2-(2-hydroxyphenyl)-1,3-diazinan-1-yl]-2-phenylacetonitrile Traditional Name: (2R)-2-[3-[(S)-cyano(phenyl)methyl]-2-(2-hydroxyphenyl)hexahydropyrimidin-1-yl]-2-phenyl-acetonitrile Formula: C26H24N4O MolecularWeight: 408.49496

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(N(C1)C(C#N)C2=CC=CC=C2)C3=CC=CC=C3O)C(C#N)C4=CC=CC=C4

Isomeric SMILES

C1CN(C(N(C1)[C@@H](C#N)C2=CC=CC=C2)C3=CC=CC=C3O)[C@H](C#N)C4=CC=CC=C4

InChI

InChI=1S/C26H24N4O/c27-18-23(20-10-3-1-4-11-20)29-16-9-17-30(24(19-28)21-12-5-2-6-13-21)26(29)22-14-7-8-15-25(22)31/h1-8,10-15,23-24,26,31H,9,16-17H2/t23-,24+,26?