4-tert-butyl-N-[5-piperazin-1-ylcarbonyl-2-(4-pyridin-3-ylcarbonylpiperazin-1-yl)phenyl]benzamide

Systemtic Name: 4-tert-butyl-N-[5-piperazin-1-ylcarbonyl-2-(4-pyridin-3-ylcarbonylpiperazin-1-yl)phenyl]benzamide Openeye Name: 4-tert-butyl-N-[5-(piperazine-1-carbonyl)-2-[4-(pyridine-3-carbonyl)piperazin-1-yl]phenyl]benzamide CAS Name: 4-tert-butyl-N-[5-[oxo(1-piperazinyl)methyl]-2-[4-[oxo(3-pyridinyl)methyl]-1-piperazinyl]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[5-(piperazine-1-carbonyl)-2-[4-(pyridine-3-carbonyl)piperazin-1-yl]phenyl]benzamide Traditional Name: 4-tert-butyl-N-[2-(4-nicotinoylpiperazino)-5-(piperazine-1-carbonyl)phenyl]benzamide Formula: C32H38N6O3 MolecularWeight: 554.68252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)N3CCNCC3)N4CCN(CC4)C(=O)C5=CN=CC=C5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)N3CCNCC3)N4CCN(CC4)C(=O)C5=CN=CC=C5

InChI

InChI=1S/C32H38N6O3/c1-32(2,3)26-9-6-23(7-10-26)29(39)35-27-21-24(30(40)37-15-13-33-14-16-37)8-11-28(27)36-17-19-38(20-18-36)31(41)25-5-4-12-34-22-25/h4-12,21-22,33H,13-20H2,1-3H3,(H,35,39)