3-[4-(azepan-1-ylsulfonyl)phenyl]-N-methyl-N-[(4-morpholin-4-ylphenyl)methyl]propanamide

Systemtic Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-methyl-N-[(4-morpholin-4-ylphenyl)methyl]propanamide Openeye Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-methyl-N-[(4-morpholinophenyl)methyl]propanamide CAS Name: 3-[4-(1-azepanylsulfonyl)phenyl]-N-methyl-N-[[4-(4-morpholinyl)phenyl]methyl]propanamide IUPAC Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-methyl-N-[(4-morpholin-4-ylphenyl)methyl]propanamide Traditional Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-methyl-N-(4-morpholinobenzyl)propionamide Formula: C27H37N3O4S MolecularWeight: 499.66538

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)N2CCOCC2)C(=O)CCC3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CN(CC1=CC=C(C=C1)N2CCOCC2)C(=O)CCC3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C27H37N3O4S/c1-28(22-24-6-11-25(12-7-24)29-18-20-34-21-19-29)27(31)15-10-23-8-13-26(14-9-23)35(32,33)30-16-4-2-3-5-17-30/h6-9,11-14H,2-5,10,15-22H2,1H3