4-(4-acetamido-2-morpholin-4-ylcarbonyl-phenyl)-N-[3-(trifluoromethyl)phenyl]-1,4-diazepane-1-carboxamide

Systemtic Name: 4-(4-acetamido-2-morpholin-4-ylcarbonyl-phenyl)-N-[3-(trifluoromethyl)phenyl]-1,4-diazepane-1-carboxamide Openeye Name: 4-[4-acetamido-2-(morpholine-4-carbonyl)phenyl]-N-[3-(trifluoromethyl)phenyl]-1,4-diazepane-1-carboxamide CAS Name: 4-[4-acetamido-2-[4-morpholinyl(oxo)methyl]phenyl]-N-[3-(trifluoromethyl)phenyl]-1,4-diazepane-1-carboxamide IUPAC Name: 4-[4-acetamido-2-(morpholine-4-carbonyl)phenyl]-N-[3-(trifluoromethyl)phenyl]-1,4-diazepane-1-carboxamide Traditional Name: 4-[4-acetamido-2-(morpholine-4-carbonyl)phenyl]-N-[3-(trifluoromethyl)phenyl]-1,4-diazepane-1-carboxamide Formula: C26H30F3N5O4 MolecularWeight: 533.54271

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)N2CCCN(CC2)C(=O)NC3=CC=CC(=C3)C(F)(F)F)C(=O)N4CCOCC4

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)N2CCCN(CC2)C(=O)NC3=CC=CC(=C3)C(F)(F)F)C(=O)N4CCOCC4

InChI

InChI=1S/C26H30F3N5O4/c1-18(35)30-21-6-7-23(22(17-21)24(36)33-12-14-38-15-13-33)32-8-3-9-34(11-10-32)25(37)31-20-5-2-4-19(16-20)26(27,28)29/h2,4-7,16-17H,3,8-15H2,1H3,(H,30,35)(H,31,37)