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

Systemtic Name: N-butyl-4-[5-[(4-chlorophenyl)methyl]-6-methyl-2-phenyl-pyrimidin-4-yl]piperazine-1-carboxamide Openeye Name: N-butyl-4-[5-[(4-chlorophenyl)methyl]-6-methyl-2-phenyl-pyrimidin-4-yl]piperazine-1-carboxamide CAS Name: N-butyl-4-[5-[(4-chlorophenyl)methyl]-6-methyl-2-phenyl-4-pyrimidinyl]-1-piperazinecarboxamide IUPAC Name: N-butyl-4-[5-[(4-chlorophenyl)methyl]-6-methyl-2-phenylpyrimidin-4-yl]piperazine-1-carboxamide Traditional Name: N-butyl-4-[5-(4-chlorobenzyl)-6-methyl-2-phenyl-pyrimidin-4-yl]piperazine-1-carboxamide Formula: C27H32ClN5O MolecularWeight: 478.02888

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N1CCN(CC1)C2=NC(=NC(=C2CC3=CC=C(C=C3)Cl)C)C4=CC=CC=C4

Isomeric SMILES

CCCCNC(=O)N1CCN(CC1)C2=NC(=NC(=C2CC3=CC=C(C=C3)Cl)C)C4=CC=CC=C4

InChI

InChI=1S/C27H32ClN5O/c1-3-4-14-29-27(34)33-17-15-32(16-18-33)26-24(19-21-10-12-23(28)13-11-21)20(2)30-25(31-26)22-8-6-5-7-9-22/h5-13H,3-4,14-19H2,1-2H3,(H,29,34)