N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-2-(1H-indol-3-yl)-2-oxidanylidene-ethanamide

Systemtic Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-2-(1H-indol-3-yl)-2-oxidanylidene-ethanamide Openeye Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-2-(1H-indol-3-yl)-2-oxo-acetamide CAS Name: N-[3-[6-(1-azepanyl)-3-pyridazinyl]phenyl]-2-(1H-indol-3-yl)-2-oxoacetamide IUPAC Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-2-(1H-indol-3-yl)-2-oxoacetamide Traditional Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-2-(1H-indol-3-yl)-2-keto-acetamide Formula: C26H25N5O2 MolecularWeight: 439.509

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NN=C(C=C2)C3=CC(=CC=C3)NC(=O)C(=O)C4=CNC5=CC=CC=C54

Isomeric SMILES

C1CCCN(CC1)C2=NN=C(C=C2)C3=CC(=CC=C3)NC(=O)C(=O)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C26H25N5O2/c32-25(21-17-27-23-11-4-3-10-20(21)23)26(33)28-19-9-7-8-18(16-19)22-12-13-24(30-29-22)31-14-5-1-2-6-15-31/h3-4,7-13,16-17,27H,1-2,5-6,14-15H2,(H,28,33)