N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-7-methoxy-1-benzofuran-2-carboxamide

Systemtic Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-7-methoxy-1-benzofuran-2-carboxamide Openeye Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-7-methoxy-benzofuran-2-carboxamide CAS Name: N-[3-[6-(1-azepanyl)-3-pyridazinyl]phenyl]-7-methoxy-2-benzofurancarboxamide IUPAC Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-7-methoxy-1-benzofuran-2-carboxamide Traditional Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-7-methoxy-coumarilamide Formula: C26H26N4O3 MolecularWeight: 442.50964

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC(=C2)C(=O)NC3=CC=CC(=C3)C4=NN=C(C=C4)N5CCCCCC5

Isomeric SMILES

COC1=CC=CC2=C1OC(=C2)C(=O)NC3=CC=CC(=C3)C4=NN=C(C=C4)N5CCCCCC5

InChI

InChI=1S/C26H26N4O3/c1-32-22-11-7-9-19-17-23(33-25(19)22)26(31)27-20-10-6-8-18(16-20)21-12-13-24(29-28-21)30-14-4-2-3-5-15-30/h6-13,16-17H,2-5,14-15H2,1H3,(H,27,31)