N-[[3-methoxy-4-(2-pyridin-2-ylethoxy)phenyl]methyl]-4-morpholin-4-yl-N-[(3S)-2-oxidanylideneazepan-3-yl]benzamide

Systemtic Name: N-[[3-methoxy-4-(2-pyridin-2-ylethoxy)phenyl]methyl]-4-morpholin-4-yl-N-[(3S)-2-oxidanylideneazepan-3-yl]benzamide Openeye Name: N-[[3-methoxy-4-[2-(2-pyridyl)ethoxy]phenyl]methyl]-4-morpholino-N-[(3S)-2-oxoazepan-3-yl]benzamide CAS Name: N-[[3-methoxy-4-[2-(2-pyridinyl)ethoxy]phenyl]methyl]-4-(4-morpholinyl)-N-[(3S)-2-oxo-3-azepanyl]benzamide IUPAC Name: N-[[3-methoxy-4-(2-pyridin-2-ylethoxy)phenyl]methyl]-4-morpholin-4-yl-N-[(3S)-2-oxoazepan-3-yl]benzamide Traditional Name: N-[(3S)-2-ketoazepan-3-yl]-N-[3-methoxy-4-[2-(2-pyridyl)ethoxy]benzyl]-4-morpholino-benzamide Formula: C32H38N4O5 MolecularWeight: 558.66792

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN(C2CCCCNC2=O)C(=O)C3=CC=C(C=C3)N4CCOCC4)OCCC5=CC=CC=N5

Isomeric SMILES

COC1=C(C=CC(=C1)CN([C@H]2CCCCNC2=O)C(=O)C3=CC=C(C=C3)N4CCOCC4)OCCC5=CC=CC=N5

InChI

InChI=1S/C32H38N4O5/c1-39-30-22-24(8-13-29(30)41-19-14-26-6-2-4-15-33-26)23-36(28-7-3-5-16-34-31(28)37)32(38)25-9-11-27(12-10-25)35-17-20-40-21-18-35/h2,4,6,8-13,15,22,28H,3,5,7,14,16-21,23H2,1H3,(H,34,37)/t28-/m0/s1