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

Systemtic Name: N-[4-[3-[(3-chlorophenyl)methyl]-2-oxidanylidene-1,3-diazinan-1-yl]phenyl]cyclobutanecarboxamide Openeye Name: N-[4-[3-[(3-chlorophenyl)methyl]-2-oxo-hexahydropyrimidin-1-yl]phenyl]cyclobutanecarboxamide CAS Name: N-[4-[3-[(3-chlorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl]phenyl]cyclobutanecarboxamide IUPAC Name: N-[4-[3-[(3-chlorophenyl)methyl]-2-oxo-1,3-diazinan-1-yl]phenyl]cyclobutanecarboxamide Traditional Name: N-[4-[3-(3-chlorobenzyl)-2-keto-hexahydropyrimidin-1-yl]phenyl]cyclobutanecarboxamide Formula: C22H24ClN3O2 MolecularWeight: 397.89786

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24ClN3O2/c23-18-7-1-4-16(14-18)15-25-12-3-13-26(22(25)28)20-10-8-19(9-11-20)24-21(27)17-5-2-6-17/h1,4,7-11,14,17H,2-3,5-6,12-13,15H2,(H,24,27)