5-(azepan-1-ylsulfonyl)-2-methoxy-N-[(4-morpholin-4-ylphenyl)methyl]benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-2-methoxy-N-[(4-morpholin-4-ylphenyl)methyl]benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-2-methoxy-N-[(4-morpholinophenyl)methyl]benzamide CAS Name: 5-(1-azepanylsulfonyl)-2-methoxy-N-[[4-(4-morpholinyl)phenyl]methyl]benzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-2-methoxy-N-[(4-morpholin-4-ylphenyl)methyl]benzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-2-methoxy-N-(4-morpholinobenzyl)benzamide Formula: C25H33N3O5S MolecularWeight: 487.61162

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NCC3=CC=C(C=C3)N4CCOCC4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)C(=O)NCC3=CC=C(C=C3)N4CCOCC4

InChI

InChI=1S/C25H33N3O5S/c1-32-24-11-10-22(34(30,31)28-12-4-2-3-5-13-28)18-23(24)25(29)26-19-20-6-8-21(9-7-20)27-14-16-33-17-15-27/h6-11,18H,2-5,12-17,19H2,1H3,(H,26,29)