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

Systemtic Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(4-morpholin-4-ylphenyl)propanamide Openeye Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(4-morpholinophenyl)propanamide CAS Name: 3-[4-(1-azepanylsulfonyl)phenyl]-N-[4-(4-morpholinyl)phenyl]propanamide IUPAC Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(4-morpholin-4-ylphenyl)propanamide Traditional Name: 3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(4-morpholinophenyl)propionamide Formula: C25H33N3O4S MolecularWeight: 471.61222

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NC3=CC=C(C=C3)N4CCOCC4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NC3=CC=C(C=C3)N4CCOCC4

InChI

InChI=1S/C25H33N3O4S/c29-25(26-22-8-10-23(11-9-22)27-17-19-32-20-18-27)14-7-21-5-12-24(13-6-21)33(30,31)28-15-3-1-2-4-16-28/h5-6,8-13H,1-4,7,14-20H2,(H,26,29)