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

Systemtic Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]-2-(4-methylphenyl)-2-oxidanylidene-ethanamide Openeye Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]-2-oxo-2-(p-tolyl)acetamide CAS Name: N-[2-(1-azepanyl)-5-(4-morpholinylsulfonyl)phenyl]-2-(4-methylphenyl)-2-oxoacetamide IUPAC Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonylphenyl]-2-(4-methylphenyl)-2-oxoacetamide Traditional Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]-2-keto-2-(p-tolyl)acetamide Formula: C25H31N3O5S MolecularWeight: 485.59574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCCCC4

InChI

InChI=1S/C25H31N3O5S/c1-19-6-8-20(9-7-19)24(29)25(30)26-22-18-21(34(31,32)28-14-16-33-17-15-28)10-11-23(22)27-12-4-2-3-5-13-27/h6-11,18H,2-5,12-17H2,1H3,(H,26,30)