N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-2-chloranyl-6-fluoranyl-benzamide

Systemtic Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-2-chloranyl-6-fluoranyl-benzamide Openeye Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-2-chloro-6-fluoro-benzamide CAS Name: N-[3-[6-(1-azepanyl)-3-pyridazinyl]phenyl]-2-chloro-6-fluorobenzamide IUPAC Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-2-chloro-6-fluorobenzamide Traditional Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-2-chloro-6-fluoro-benzamide Formula: C23H22ClFN4O MolecularWeight: 424.898383

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NN=C(C=C2)C3=CC(=CC=C3)NC(=O)C4=C(C=CC=C4Cl)F

Isomeric SMILES

C1CCCN(CC1)C2=NN=C(C=C2)C3=CC(=CC=C3)NC(=O)C4=C(C=CC=C4Cl)F

InChI

InChI=1S/C23H22ClFN4O/c24-18-9-6-10-19(25)22(18)23(30)26-17-8-5-7-16(15-17)20-11-12-21(28-27-20)29-13-3-1-2-4-14-29/h5-12,15H,1-4,13-14H2,(H,26,30)