N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]pyridine-4-carboxamide

Systemtic Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]pyridine-4-carboxamide Openeye Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]pyridine-4-carboxamide CAS Name: N-[3-[6-(1-azepanyl)-3-pyridazinyl]phenyl]-4-pyridinecarboxamide IUPAC Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]pyridine-4-carboxamide Traditional Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]isonicotinamide Formula: C22H23N5O MolecularWeight: 373.45092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N5O/c28-22(17-10-12-23-13-11-17)24-19-7-5-6-18(16-19)20-8-9-21(26-25-20)27-14-3-1-2-4-15-27/h5-13,16H,1-4,14-15H2,(H,24,28)