4-[5-[(3-chlorophenyl)methyl]-6-ethyl-2-phenyl-pyrimidin-4-yl]-N,N-dimethyl-piperazine-1-carboxamide

Systemtic Name: 4-[5-[(3-chlorophenyl)methyl]-6-ethyl-2-phenyl-pyrimidin-4-yl]-N,N-dimethyl-piperazine-1-carboxamide Openeye Name: 4-[5-[(3-chlorophenyl)methyl]-6-ethyl-2-phenyl-pyrimidin-4-yl]-N,N-dimethyl-piperazine-1-carboxamide CAS Name: 4-[5-[(3-chlorophenyl)methyl]-6-ethyl-2-phenyl-4-pyrimidinyl]-N,N-dimethyl-1-piperazinecarboxamide IUPAC Name: 4-[5-[(3-chlorophenyl)methyl]-6-ethyl-2-phenylpyrimidin-4-yl]-N,N-dimethylpiperazine-1-carboxamide Traditional Name: 4-[5-(3-chlorobenzyl)-6-ethyl-2-phenyl-pyrimidin-4-yl]-N,N-dimethyl-piperazine-1-carboxamide Formula: C26H30ClN5O MolecularWeight: 464.0023

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)C2=CC=CC=C2)N3CCN(CC3)C(=O)N(C)C)CC4=CC(=CC=C4)Cl

Isomeric SMILES

CCC1=C(C(=NC(=N1)C2=CC=CC=C2)N3CCN(CC3)C(=O)N(C)C)CC4=CC(=CC=C4)Cl

InChI

InChI=1S/C26H30ClN5O/c1-4-23-22(18-19-9-8-12-21(27)17-19)25(29-24(28-23)20-10-6-5-7-11-20)31-13-15-32(16-14-31)26(33)30(2)3/h5-12,17H,4,13-16,18H2,1-3H3