N-[2-(azepan-1-ylcarbonyl)phenyl]-2-[methylsulfonyl-(4-morpholin-4-ylsulfonylphenyl)amino]ethanamide

Systemtic Name: N-[2-(azepan-1-ylcarbonyl)phenyl]-2-[methylsulfonyl-(4-morpholin-4-ylsulfonylphenyl)amino]ethanamide Openeye Name: N-[2-(azepane-1-carbonyl)phenyl]-2-(N-methylsulfonyl-4-morpholinosulfonyl-anilino)acetamide CAS Name: N-[2-[1-azepanyl(oxo)methyl]phenyl]-2-[N-methylsulfonyl-4-(4-morpholinylsulfonyl)anilino]acetamide IUPAC Name: N-[2-(azepane-1-carbonyl)phenyl]-2-(N-methylsulfonyl-4-morpholin-4-ylsulfonylanilino)acetamide Traditional Name: N-[2-(azepane-1-carbonyl)phenyl]-2-(N-mesyl-4-morpholinosulfonyl-anilino)acetamide Formula: C26H34N4O7S2 MolecularWeight: 578.70076

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NC1=CC=CC=C1C(=O)N2CCCCCC2)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NC1=CC=CC=C1C(=O)N2CCCCCC2)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C26H34N4O7S2/c1-38(33,34)30(21-10-12-22(13-11-21)39(35,36)29-16-18-37-19-17-29)20-25(31)27-24-9-5-4-8-23(24)26(32)28-14-6-2-3-7-15-28/h4-5,8-13H,2-3,6-7,14-20H2,1H3,(H,27,31)