N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[(2-fluorophenyl)methylsulfanyl]ethanamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[(2-fluorophenyl)methylsulfanyl]ethanamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[(2-fluorophenyl)methylsulfanyl]acetamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[(2-fluorophenyl)methylthio]acetamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[(2-fluorophenyl)methylsulfanyl]acetamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[(2-fluorobenzyl)thio]acetamide Formula: C18H18FNO3S MolecularWeight: 347.403823

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=O)CSCC3=CC=CC=C3F)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=O)CSCC3=CC=CC=C3F)OC1

InChI

InChI=1S/C18H18FNO3S/c19-15-5-2-1-4-13(15)11-24-12-18(21)20-14-6-7-16-17(10-14)23-9-3-8-22-16/h1-2,4-7,10H,3,8-9,11-12H2,(H,20,21)