(9-methoxy-7-thiophen-2-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-(4-morpholin-4-ylphenyl)methanone

Systemtic Name: (9-methoxy-7-thiophen-2-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-(4-morpholin-4-ylphenyl)methanone Openeye Name: [9-methoxy-7-(2-thienyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(4-morpholinophenyl)methanone CAS Name: (9-methoxy-7-thiophen-2-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-[4-(4-morpholinyl)phenyl]methanone IUPAC Name: (9-methoxy-7-thiophen-2-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-(4-morpholin-4-ylphenyl)methanone Traditional Name: [9-methoxy-7-(2-thienyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-(4-morpholinophenyl)methanone Formula: C25H26N2O4S MolecularWeight: 450.54994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCCN(C2)C(=O)C3=CC=C(C=C3)N4CCOCC4)C5=CC=CS5

Isomeric SMILES

COC1=CC(=CC2=C1OCCN(C2)C(=O)C3=CC=C(C=C3)N4CCOCC4)C5=CC=CS5

InChI

InChI=1S/C25H26N2O4S/c1-29-22-16-19(23-3-2-14-32-23)15-20-17-27(10-13-31-24(20)22)25(28)18-4-6-21(7-5-18)26-8-11-30-12-9-26/h2-7,14-16H,8-13,17H2,1H3