3-(azepan-1-ylsulfonyl)-N-[(2-morpholin-4-ylpyridin-4-yl)methyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[(2-morpholin-4-ylpyridin-4-yl)methyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[(2-morpholino-4-pyridyl)methyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[[2-(4-morpholinyl)-4-pyridinyl]methyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[(2-morpholin-4-ylpyridin-4-yl)methyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-[(2-morpholino-4-pyridyl)methyl]benzamide Formula: C23H30N4O4S MolecularWeight: 458.5737

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCC3=CC(=NC=C3)N4CCOCC4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCC3=CC(=NC=C3)N4CCOCC4

InChI

InChI=1S/C23H30N4O4S/c28-23(25-18-19-8-9-24-22(16-19)26-12-14-31-15-13-26)20-6-5-7-21(17-20)32(29,30)27-10-3-1-2-4-11-27/h5-9,16-17H,1-4,10-15,18H2,(H,25,28)