5-(2,4-dichlorophenyl)-3-(1-phenyl-2-pyrrolidin-1-yl-ethyl)pyrimidin-4-one

Systemtic Name: 5-(2,4-dichlorophenyl)-3-(1-phenyl-2-pyrrolidin-1-yl-ethyl)pyrimidin-4-one Openeye Name: 5-(2,4-dichlorophenyl)-3-(1-phenyl-2-pyrrolidin-1-yl-ethyl)pyrimidin-4-one CAS Name: 5-(2,4-dichlorophenyl)-3-[1-phenyl-2-(1-pyrrolidinyl)ethyl]-4-pyrimidinone IUPAC Name: 5-(2,4-dichlorophenyl)-3-(1-phenyl-2-pyrrolidin-1-ylethyl)pyrimidin-4-one Traditional Name: 5-(2,4-dichlorophenyl)-3-(1-phenyl-2-pyrrolidino-ethyl)pyrimidin-4-one Formula: C22H21Cl2N3O MolecularWeight: 414.32764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC(C2=CC=CC=C2)N3C=NC=C(C3=O)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C1CCN(C1)CC(C2=CC=CC=C2)N3C=NC=C(C3=O)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C22H21Cl2N3O/c23-17-8-9-18(20(24)12-17)19-13-25-15-27(22(19)28)21(14-26-10-4-5-11-26)16-6-2-1-3-7-16/h1-3,6-9,12-13,15,21H,4-5,10-11,14H2