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

Systemtic Name: N-[4-[3-[(3-cyanophenyl)methyl]-2-oxidanylidene-1,3-diazinan-1-yl]phenyl]-3-fluoranyl-benzamide Openeye Name: N-[4-[3-[(3-cyanophenyl)methyl]-2-oxo-hexahydropyrimidin-1-yl]phenyl]-3-fluoro-benzamide CAS Name: N-[4-[3-[(3-cyanophenyl)methyl]-2-oxo-1,3-diazinan-1-yl]phenyl]-3-fluorobenzamide IUPAC Name: N-[4-[3-[(3-cyanophenyl)methyl]-2-oxo-1,3-diazinan-1-yl]phenyl]-3-fluorobenzamide Traditional Name: N-[4-[3-(3-cyanobenzyl)-2-keto-hexahydropyrimidin-1-yl]phenyl]-3-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=C3)F)CC4=CC=CC(=C4)C#N

Isomeric SMILES

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

InChI

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