N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]-9H-xanthene-9-carboxamide

Systemtic Name: N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]-9H-xanthene-9-carboxamide Openeye Name: N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]-9H-xanthene-9-carboxamide CAS Name: N-[3-[6-(1-pyrrolidinyl)-3-pyridazinyl]phenyl]-9H-xanthene-9-carboxamide IUPAC Name: N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]-9H-xanthene-9-carboxamide Traditional Name: N-[3-(6-pyrrolidinopyridazin-3-yl)phenyl]-9H-xanthene-9-carboxamide Formula: C28H24N4O2 MolecularWeight: 448.51576

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NN=C(C=C2)C3=CC(=CC=C3)NC(=O)C4C5=CC=CC=C5OC6=CC=CC=C46

Isomeric SMILES

C1CCN(C1)C2=NN=C(C=C2)C3=CC(=CC=C3)NC(=O)C4C5=CC=CC=C5OC6=CC=CC=C46

InChI

InChI=1S/C28H24N4O2/c33-28(27-21-10-1-3-12-24(21)34-25-13-4-2-11-22(25)27)29-20-9-7-8-19(18-20)23-14-15-26(31-30-23)32-16-5-6-17-32/h1-4,7-15,18,27H,5-6,16-17H2,(H,29,33)