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

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-(3,5-dimethoxyphenyl)ethanamide Openeye Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-(3,5-dimethoxyphenyl)acetamide CAS Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-N-(3,5-dimethoxyphenyl)acetamide IUPAC Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)-N-(3,5-dimethoxyphenyl)acetamide Traditional Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-N-(3,5-dimethoxyphenyl)acetamide Formula: C19H21NO5S MolecularWeight: 375.43874

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21NO5S/c1-22-14-8-13(9-15(10-14)23-2)20-19(21)12-26-16-4-5-17-18(11-16)25-7-3-6-24-17/h4-5,8-11H,3,6-7,12H2,1-2H3,(H,20,21)