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

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[(2,5-dimethylphenyl)methylsulfanyl]ethanamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[(2,5-dimethylphenyl)methylsulfanyl]acetamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[(2,5-dimethylphenyl)methylthio]acetamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[(2,5-dimethylphenyl)methylsulfanyl]acetamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[(2,5-dimethylbenzyl)thio]acetamide Formula: C20H23NO3S MolecularWeight: 357.46652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CSCC(=O)NC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC1=CC(=C(C=C1)C)CSCC(=O)NC2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C20H23NO3S/c1-14-4-5-15(2)16(10-14)12-25-13-20(22)21-17-6-7-18-19(11-17)24-9-3-8-23-18/h4-7,10-11H,3,8-9,12-13H2,1-2H3,(H,21,22)