4-[[3-[[2-bromanyl-5-(1-methoxyethoxy)phenyl]methyl]pyrrolidin-1-yl]methyl]-1-phenyl-1,3-diazinan-2-one

Systemtic Name: 4-[[3-[[2-bromanyl-5-(1-methoxyethoxy)phenyl]methyl]pyrrolidin-1-yl]methyl]-1-phenyl-1,3-diazinan-2-one Openeye Name: 4-[[3-[[2-bromo-5-(1-methoxyethoxy)phenyl]methyl]pyrrolidin-1-yl]methyl]-1-phenyl-hexahydropyrimidin-2-one CAS Name: 4-[[3-[[2-bromo-5-(1-methoxyethoxy)phenyl]methyl]-1-pyrrolidinyl]methyl]-1-phenyl-1,3-diazinan-2-one IUPAC Name: 4-[[3-[[2-bromo-5-(1-methoxyethoxy)phenyl]methyl]pyrrolidin-1-yl]methyl]-1-phenyl-1,3-diazinan-2-one Traditional Name: 4-[[3-[2-bromo-5-(1-methoxyethoxy)benzyl]pyrrolidino]methyl]-1-phenyl-hexahydropyrimidin-2-one Formula: C25H32BrN3O3 MolecularWeight: 502.44388

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Descriptors Computed from Structure

Canonical SMILES:

CC(OC)OC1=CC(=C(C=C1)Br)CC2CCN(C2)CC3CCN(C(=O)N3)C4=CC=CC=C4

Isomeric SMILES

CC(OC)OC1=CC(=C(C=C1)Br)CC2CCN(C2)CC3CCN(C(=O)N3)C4=CC=CC=C4

InChI

InChI=1S/C25H32BrN3O3/c1-18(31-2)32-23-8-9-24(26)20(15-23)14-19-10-12-28(16-19)17-21-11-13-29(25(30)27-21)22-6-4-3-5-7-22/h3-9,15,18-19,21H,10-14,16-17H2,1-2H3,(H,27,30)