N3-[1-(4-chlorophenyl)ethyl]-4-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-N1-phenyl-piperazine-1,3-dicarboxamide

Systemtic Name: N3-[1-(4-chlorophenyl)ethyl]-4-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-N1-phenyl-piperazine-1,3-dicarboxamide Openeye Name: N3-[1-(4-chlorophenyl)ethyl]-4-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-N1-phenyl-piperazine-1,3-dicarboxamide CAS Name: N3-[1-(4-chlorophenyl)ethyl]-4-[2-(1-imidazolyl)-6-methyl-4-pyrimidinyl]-N1-phenylpiperazine-1,3-dicarboxamide IUPAC Name: 3-N-[1-(4-chlorophenyl)ethyl]-4-(2-imidazol-1-yl-6-methylpyrimidin-4-yl)-1-N-phenylpiperazine-1,3-dicarboxamide Traditional Name: N'-[1-(4-chlorophenyl)ethyl]-4-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-N-phenyl-piperazine-1,3-dicarboxamide Formula: C28H29ClN8O2 MolecularWeight: 545.03526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C=CN=C2)N3CCN(CC3C(=O)NC(C)C4=CC=C(C=C4)Cl)C(=O)NC5=CC=CC=C5

Isomeric SMILES

CC1=CC(=NC(=N1)N2C=CN=C2)N3CCN(CC3C(=O)NC(C)C4=CC=C(C=C4)Cl)C(=O)NC5=CC=CC=C5

InChI

InChI=1S/C28H29ClN8O2/c1-19-16-25(34-27(31-19)36-13-12-30-18-36)37-15-14-35(28(39)33-23-6-4-3-5-7-23)17-24(37)26(38)32-20(2)21-8-10-22(29)11-9-21/h3-13,16,18,20,24H,14-15,17H2,1-2H3,(H,32,38)(H,33,39)