2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-[(3-methoxyphenyl)methyl]ethanamide

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-[(3-methoxyphenyl)methyl]ethanamide Openeye Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-[(3-methoxyphenyl)methyl]acetamide CAS Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-N-[(3-methoxyphenyl)methyl]acetamide IUPAC Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-[(3-methoxyphenyl)methyl]acetamide Traditional Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-N-m-anisyl-acetamide Formula: C19H21NO4S MolecularWeight: 359.43934

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNC(=O)CSC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

COC1=CC=CC(=C1)CNC(=O)CSC2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C19H21NO4S/c1-22-15-5-2-4-14(10-15)12-20-19(21)13-25-16-6-7-17-18(11-16)24-9-3-8-23-17/h2,4-7,10-11H,3,8-9,12-13H2,1H3,(H,20,21)