N-[3-(azepan-1-ylsulfonyl)phenyl]-4-morpholin-4-yl-pyridine-2-carboxamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-4-morpholin-4-yl-pyridine-2-carboxamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-4-morpholino-pyridine-2-carboxamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-4-(4-morpholinyl)-2-pyridinecarboxamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-4-morpholin-4-ylpyridine-2-carboxamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-4-morpholino-picolinamide Formula: C22H28N4O4S MolecularWeight: 444.54712

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=NC=CC(=C3)N4CCOCC4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3=NC=CC(=C3)N4CCOCC4

InChI

InChI=1S/C22H28N4O4S/c27-22(21-17-19(8-9-23-21)25-12-14-30-15-13-25)24-18-6-5-7-20(16-18)31(28,29)26-10-3-1-2-4-11-26/h5-9,16-17H,1-4,10-15H2,(H,24,27)