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

Systemtic Name: 4-[5-[(4-chlorophenyl)methyl]-6-ethyl-2-methyl-pyrimidin-4-yl]-N-phenyl-piperazine-1-carboxamide Openeye Name: 4-[5-[(4-chlorophenyl)methyl]-6-ethyl-2-methyl-pyrimidin-4-yl]-N-phenyl-piperazine-1-carboxamide CAS Name: 4-[5-[(4-chlorophenyl)methyl]-6-ethyl-2-methyl-4-pyrimidinyl]-N-phenyl-1-piperazinecarboxamide IUPAC Name: 4-[5-[(4-chlorophenyl)methyl]-6-ethyl-2-methylpyrimidin-4-yl]-N-phenylpiperazine-1-carboxamide Traditional Name: 4-[5-(4-chlorobenzyl)-6-ethyl-2-methyl-pyrimidin-4-yl]-N-phenyl-piperazine-1-carboxamide Formula: C25H28ClN5O MolecularWeight: 449.97572

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)C)N2CCN(CC2)C(=O)NC3=CC=CC=C3)CC4=CC=C(C=C4)Cl

Isomeric SMILES

CCC1=C(C(=NC(=N1)C)N2CCN(CC2)C(=O)NC3=CC=CC=C3)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H28ClN5O/c1-3-23-22(17-19-9-11-20(26)12-10-19)24(28-18(2)27-23)30-13-15-31(16-14-30)25(32)29-21-7-5-4-6-8-21/h4-12H,3,13-17H2,1-2H3,(H,29,32)