N-[4-[3-[(4-cyanophenyl)methyl]-2-oxidanylidene-1,3-diazinan-1-yl]phenyl]-2-methyl-benzamide

Systemtic Name: N-[4-[3-[(4-cyanophenyl)methyl]-2-oxidanylidene-1,3-diazinan-1-yl]phenyl]-2-methyl-benzamide Openeye Name: N-[4-[3-[(4-cyanophenyl)methyl]-2-oxo-hexahydropyrimidin-1-yl]phenyl]-2-methyl-benzamide CAS Name: N-[4-[3-[(4-cyanophenyl)methyl]-2-oxo-1,3-diazinan-1-yl]phenyl]-2-methylbenzamide IUPAC Name: N-[4-[3-[(4-cyanophenyl)methyl]-2-oxo-1,3-diazinan-1-yl]phenyl]-2-methylbenzamide Traditional Name: N-[4-[3-(4-cyanobenzyl)-2-keto-hexahydropyrimidin-1-yl]phenyl]-2-methyl-benzamide Formula: C26H24N4O2 MolecularWeight: 424.49436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)N3CCCN(C3=O)CC4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)N3CCCN(C3=O)CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C26H24N4O2/c1-19-5-2-3-6-24(19)25(31)28-22-11-13-23(14-12-22)30-16-4-15-29(26(30)32)18-21-9-7-20(17-27)8-10-21/h2-3,5-14H,4,15-16,18H2,1H3,(H,28,31)