N-[5-(1,4-diazepan-1-ylcarbonyl)-2-(4-pyridin-4-ylcarbonyl-1,4-diazepan-1-yl)phenyl]-3-fluoranyl-benzamide

Systemtic Name: N-[5-(1,4-diazepan-1-ylcarbonyl)-2-(4-pyridin-4-ylcarbonyl-1,4-diazepan-1-yl)phenyl]-3-fluoranyl-benzamide Openeye Name: N-[5-(1,4-diazepane-1-carbonyl)-2-[4-(pyridine-4-carbonyl)-1,4-diazepan-1-yl]phenyl]-3-fluoro-benzamide CAS Name: N-[5-[1,4-diazepan-1-yl(oxo)methyl]-2-[4-[oxo(pyridin-4-yl)methyl]-1,4-diazepan-1-yl]phenyl]-3-fluorobenzamide IUPAC Name: N-[5-(1,4-diazepane-1-carbonyl)-2-[4-(pyridine-4-carbonyl)-1,4-diazepan-1-yl]phenyl]-3-fluorobenzamide Traditional Name: N-[5-(1,4-diazepane-1-carbonyl)-2-(4-isonicotinoyl-1,4-diazepan-1-yl)phenyl]-3-fluoro-benzamide Formula: C30H33FN6O3 MolecularWeight: 544.619823

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(=O)C2=CC(=C(C=C2)N3CCCN(CC3)C(=O)C4=CC=NC=C4)NC(=O)C5=CC(=CC=C5)F

Isomeric SMILES

C1CNCCN(C1)C(=O)C2=CC(=C(C=C2)N3CCCN(CC3)C(=O)C4=CC=NC=C4)NC(=O)C5=CC(=CC=C5)F

InChI

InChI=1S/C30H33FN6O3/c31-25-5-1-4-23(20-25)28(38)34-26-21-24(30(40)36-14-2-10-32-13-17-36)6-7-27(26)35-15-3-16-37(19-18-35)29(39)22-8-11-33-12-9-22/h1,4-9,11-12,20-21,32H,2-3,10,13-19H2,(H,34,38)