N1-tert-butyl-N2-[2-[3-[(4-cyanophenyl)methyl]imidazol-4-yl]ethyl]-4-pyridin-4-ylcarbonyl-piperazine-1,2-dicarboxamide

Systemtic Name: N1-tert-butyl-N2-[2-[3-[(4-cyanophenyl)methyl]imidazol-4-yl]ethyl]-4-pyridin-4-ylcarbonyl-piperazine-1,2-dicarboxamide Openeye Name: N1-tert-butyl-N2-[2-[3-[(4-cyanophenyl)methyl]imidazol-4-yl]ethyl]-4-(pyridine-4-carbonyl)piperazine-1,2-dicarboxamide CAS Name: N1-tert-butyl-N2-[2-[3-[(4-cyanophenyl)methyl]-4-imidazolyl]ethyl]-4-[oxo(pyridin-4-yl)methyl]piperazine-1,2-dicarboxamide IUPAC Name: 1-N-tert-butyl-2-N-[2-[3-[(4-cyanophenyl)methyl]imidazol-4-yl]ethyl]-4-(pyridine-4-carbonyl)piperazine-1,2-dicarboxamide Traditional Name: N-tert-butyl-N'-[2-[3-(4-cyanobenzyl)imidazol-4-yl]ethyl]-4-isonicotinoyl-piperazine-1,2-dicarboxamide Formula: C29H34N8O3 MolecularWeight: 542.63206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)N1CCN(CC1C(=O)NCCC2=CN=CN2CC3=CC=C(C=C3)C#N)C(=O)C4=CC=NC=C4

Isomeric SMILES

CC(C)(C)NC(=O)N1CCN(CC1C(=O)NCCC2=CN=CN2CC3=CC=C(C=C3)C#N)C(=O)C4=CC=NC=C4

InChI

InChI=1S/C29H34N8O3/c1-29(2,3)34-28(40)37-15-14-35(27(39)23-8-11-31-12-9-23)19-25(37)26(38)33-13-10-24-17-32-20-36(24)18-22-6-4-21(16-30)5-7-22/h4-9,11-12,17,20,25H,10,13-15,18-19H2,1-3H3,(H,33,38)(H,34,40)