4-(5-fluoranyl-2-methyl-phenyl)sulfonyl-9-methoxy-7-quinolin-3-yl-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: 4-(5-fluoranyl-2-methyl-phenyl)sulfonyl-9-methoxy-7-quinolin-3-yl-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 4-(5-fluoro-2-methyl-phenyl)sulfonyl-9-methoxy-7-(3-quinolyl)-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 4-(5-fluoro-2-methylphenyl)sulfonyl-9-methoxy-7-(3-quinolinyl)-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 4-(5-fluoro-2-methylphenyl)sulfonyl-9-methoxy-7-quinolin-3-yl-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 4-(5-fluoro-2-methyl-phenyl)sulfonyl-9-methoxy-7-(3-quinolyl)-3,5-dihydro-2H-1,4-benzoxazepine Formula: C26H23FN2O4S MolecularWeight: 478.535223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)F)S(=O)(=O)N2CCOC3=C(C2)C=C(C=C3OC)C4=CC5=CC=CC=C5N=C4

Isomeric SMILES

CC1=C(C=C(C=C1)F)S(=O)(=O)N2CCOC3=C(C2)C=C(C=C3OC)C4=CC5=CC=CC=C5N=C4

InChI

InChI=1S/C26H23FN2O4S/c1-17-7-8-22(27)14-25(17)34(30,31)29-9-10-33-26-21(16-29)12-19(13-24(26)32-2)20-11-18-5-3-4-6-23(18)28-15-20/h3-8,11-15H,9-10,16H2,1-2H3