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

Systemtic Name: N-[4-[3-[(3-cyanophenyl)methyl]-2-oxidanylidene-1,3-diazinan-1-yl]phenyl]cyclobutanecarboxamide Openeye Name: N-[4-[3-[(3-cyanophenyl)methyl]-2-oxo-hexahydropyrimidin-1-yl]phenyl]cyclobutanecarboxamide CAS Name: N-[4-[3-[(3-cyanophenyl)methyl]-2-oxo-1,3-diazinan-1-yl]phenyl]cyclobutanecarboxamide IUPAC Name: N-[4-[3-[(3-cyanophenyl)methyl]-2-oxo-1,3-diazinan-1-yl]phenyl]cyclobutanecarboxamide Traditional Name: N-[4-[3-(3-cyanobenzyl)-2-keto-hexahydropyrimidin-1-yl]phenyl]cyclobutanecarboxamide Formula: C23H24N4O2 MolecularWeight: 388.46226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C(=O)NC2=CC=C(C=C2)N3CCCN(C3=O)CC4=CC=CC(=C4)C#N

Isomeric SMILES

C1CC(C1)C(=O)NC2=CC=C(C=C2)N3CCCN(C3=O)CC4=CC=CC(=C4)C#N

InChI

InChI=1S/C23H24N4O2/c24-15-17-4-1-5-18(14-17)16-26-12-3-13-27(23(26)29)21-10-8-20(9-11-21)25-22(28)19-6-2-7-19/h1,4-5,8-11,14,19H,2-3,6-7,12-13,16H2,(H,25,28)