2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-(2-fluoranyl-4-methyl-phenyl)ethanamide

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-(2-fluoranyl-4-methyl-phenyl)ethanamide Openeye Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-(2-fluoro-4-methyl-phenyl)acetamide CAS Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-N-(2-fluoro-4-methylphenyl)acetamide IUPAC Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-(2-fluoro-4-methylphenyl)acetamide Traditional Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-N-(2-fluoro-4-methyl-phenyl)acetamide Formula: C18H18FNO3S MolecularWeight: 347.403823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSC2=CC3=C(C=C2)OCCCO3)F

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSC2=CC3=C(C=C2)OCCCO3)F

InChI

InChI=1S/C18H18FNO3S/c1-12-3-5-15(14(19)9-12)20-18(21)11-24-13-4-6-16-17(10-13)23-8-2-7-22-16/h3-6,9-10H,2,7-8,11H2,1H3,(H,20,21)