2-bromanyl-N-[4-methylsulfanyl-2,6-di(propan-2-yl)phenyl]-6,11-dihydrobenzo[c][1]benzoxepine-11-carboxamide

Systemtic Name: 2-bromanyl-N-[4-methylsulfanyl-2,6-di(propan-2-yl)phenyl]-6,11-dihydrobenzo[c][1]benzoxepine-11-carboxamide Openeye Name: 2-bromo-N-(2,6-diisopropyl-4-methylsulfanyl-phenyl)-6,11-dihydrobenzo[c][1]benzoxepine-11-carboxamide CAS Name: 2-bromo-N-[4-(methylthio)-2,6-di(propan-2-yl)phenyl]-6,11-dihydrobenzo[c][1]benzoxepin-11-carboxamide IUPAC Name: 2-bromo-N-[4-methylsulfanyl-2,6-di(propan-2-yl)phenyl]-6,11-dihydrobenzo[c][1]benzoxepine-11-carboxamide Traditional Name: 2-bromo-N-[2,6-diisopropyl-4-(methylthio)phenyl]-6,11-dihydrobenzo[c][1]benzoxepin-11-carboxamide Formula: C28H30BrNO2S MolecularWeight: 524.5123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC(=C1NC(=O)C2C3=CC=CC=C3COC4=C2C=C(C=C4)Br)C(C)C)SC

Isomeric SMILES

CC(C)C1=CC(=CC(=C1NC(=O)C2C3=CC=CC=C3COC4=C2C=C(C=C4)Br)C(C)C)SC

InChI

InChI=1S/C28H30BrNO2S/c1-16(2)22-13-20(33-5)14-23(17(3)4)27(22)30-28(31)26-21-9-7-6-8-18(21)15-32-25-11-10-19(29)12-24(25)26/h6-14,16-17,26H,15H2,1-5H3,(H,30,31)