N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]-2-(2-methylphenyl)ethanamide

Systemtic Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]-2-(2-methylphenyl)ethanamide Openeye Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]-2-(o-tolyl)acetamide CAS Name: N-[2-(1-azepanyl)-5-(4-morpholinylsulfonyl)phenyl]-2-(2-methylphenyl)acetamide IUPAC Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonylphenyl]-2-(2-methylphenyl)acetamide Traditional Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]-2-(o-tolyl)acetamide Formula: C25H33N3O4S MolecularWeight: 471.61222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCCCC4

Isomeric SMILES

CC1=CC=CC=C1CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCCCC4

InChI

InChI=1S/C25H33N3O4S/c1-20-8-4-5-9-21(20)18-25(29)26-23-19-22(33(30,31)28-14-16-32-17-15-28)10-11-24(23)27-12-6-2-3-7-13-27/h4-5,8-11,19H,2-3,6-7,12-18H2,1H3,(H,26,29)