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

Systemtic Name: N-[4-[3-[(4-cyanophenyl)methyl]-2-oxidanylidene-1,3-diazinan-1-yl]phenyl]-2-fluoranyl-benzamide Openeye Name: N-[4-[3-[(4-cyanophenyl)methyl]-2-oxo-hexahydropyrimidin-1-yl]phenyl]-2-fluoro-benzamide CAS Name: N-[4-[3-[(4-cyanophenyl)methyl]-2-oxo-1,3-diazinan-1-yl]phenyl]-2-fluorobenzamide IUPAC Name: N-[4-[3-[(4-cyanophenyl)methyl]-2-oxo-1,3-diazinan-1-yl]phenyl]-2-fluorobenzamide Traditional Name: N-[4-[3-(4-cyanobenzyl)-2-keto-hexahydropyrimidin-1-yl]phenyl]-2-fluoro-benzamide Formula: C25H21FN4O2 MolecularWeight: 428.458243

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)N(C1)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3F)CC4=CC=C(C=C4)C#N

Isomeric SMILES

C1CN(C(=O)N(C1)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3F)CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C25H21FN4O2/c26-23-5-2-1-4-22(23)24(31)28-20-10-12-21(13-11-20)30-15-3-14-29(25(30)32)17-19-8-6-18(16-27)7-9-19/h1-2,4-13H,3,14-15,17H2,(H,28,31)