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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)N3CCCN(C3=O)CC4=CC=CC=C4C#N

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)N3CCCN(C3=O)CC4=CC=CC=C4C#N

InChI

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