N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-1H-indole-2-carboxamide

Systemtic Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-1H-indole-2-carboxamide Openeye Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-1H-indole-2-carboxamide CAS Name: N-[3-[6-(1-azepanyl)-3-pyridazinyl]phenyl]-1H-indole-2-carboxamide IUPAC Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-1H-indole-2-carboxamide Traditional Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-1H-indole-2-carboxamide Formula: C25H25N5O MolecularWeight: 411.4989

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=CC5=CC=CC=C5N4

Isomeric SMILES

C1CCCN(CC1)C2=NN=C(C=C2)C3=CC(=CC=C3)NC(=O)C4=CC5=CC=CC=C5N4

InChI

InChI=1S/C25H25N5O/c31-25(23-17-19-8-3-4-11-21(19)27-23)26-20-10-7-9-18(16-20)22-12-13-24(29-28-22)30-14-5-1-2-6-15-30/h3-4,7-13,16-17,27H,1-2,5-6,14-15H2,(H,26,31)