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

Systemtic Name: 3-chloranyl-N-[5-piperazin-1-ylcarbonyl-2-(4-pyridin-4-ylcarbonylpiperazin-1-yl)phenyl]benzamide Openeye Name: 3-chloro-N-[5-(piperazine-1-carbonyl)-2-[4-(pyridine-4-carbonyl)piperazin-1-yl]phenyl]benzamide CAS Name: 3-chloro-N-[5-[oxo(1-piperazinyl)methyl]-2-[4-[oxo(pyridin-4-yl)methyl]-1-piperazinyl]phenyl]benzamide IUPAC Name: 3-chloro-N-[5-(piperazine-1-carbonyl)-2-[4-(pyridine-4-carbonyl)piperazin-1-yl]phenyl]benzamide Traditional Name: 3-chloro-N-[2-(4-isonicotinoylpiperazino)-5-(piperazine-1-carbonyl)phenyl]benzamide Formula: C28H29ClN6O3 MolecularWeight: 533.02126

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=NC=C4)NC(=O)C5=CC(=CC=C5)Cl

Isomeric SMILES

C1CN(CCN1)C(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=NC=C4)NC(=O)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C28H29ClN6O3/c29-23-3-1-2-21(18-23)26(36)32-24-19-22(28(38)34-12-10-31-11-13-34)4-5-25(24)33-14-16-35(17-15-33)27(37)20-6-8-30-9-7-20/h1-9,18-19,31H,10-17H2,(H,32,36)