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

Systemtic Name: N-[5-(1,4-diazepan-1-ylcarbonyl)-2-(4-pyridin-4-ylcarbonyl-1,4-diazepan-1-yl)phenyl]-4-fluoranyl-benzamide Openeye Name: N-[5-(1,4-diazepane-1-carbonyl)-2-[4-(pyridine-4-carbonyl)-1,4-diazepan-1-yl]phenyl]-4-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]-4-fluorobenzamide IUPAC Name: N-[5-(1,4-diazepane-1-carbonyl)-2-[4-(pyridine-4-carbonyl)-1,4-diazepan-1-yl]phenyl]-4-fluorobenzamide Traditional Name: N-[5-(1,4-diazepane-1-carbonyl)-2-(4-isonicotinoyl-1,4-diazepan-1-yl)phenyl]-4-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=C(C=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=C(C=C5)F

InChI

InChI=1S/C30H33FN6O3/c31-25-6-3-22(4-7-25)28(38)34-26-21-24(30(40)36-15-1-11-32-14-18-36)5-8-27(26)35-16-2-17-37(20-19-35)29(39)23-9-12-33-13-10-23/h3-10,12-13,21,32H,1-2,11,14-20H2,(H,34,38)