N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[(3-ethanoyl-2,4,6-trimethyl-phenyl)methylsulfanyl]ethanamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[(3-ethanoyl-2,4,6-trimethyl-phenyl)methylsulfanyl]ethanamide Openeye Name: 2-[(3-acetyl-2,4,6-trimethyl-phenyl)methylsulfanyl]-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide CAS Name: 2-[(3-acetyl-2,4,6-trimethylphenyl)methylthio]-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide IUPAC Name: 2-[(3-acetyl-2,4,6-trimethylphenyl)methylsulfanyl]-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide Traditional Name: 2-[(3-acetyl-2,4,6-trimethyl-benzyl)thio]-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide Formula: C23H27NO4S MolecularWeight: 413.52978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C(=O)C)C)CSCC(=O)NC2=CC3=C(C=C2)OCCCO3)C

Isomeric SMILES

CC1=CC(=C(C(=C1C(=O)C)C)CSCC(=O)NC2=CC3=C(C=C2)OCCCO3)C

InChI

InChI=1S/C23H27NO4S/c1-14-10-15(2)23(17(4)25)16(3)19(14)12-29-13-22(26)24-18-6-7-20-21(11-18)28-9-5-8-27-20/h6-7,10-11H,5,8-9,12-13H2,1-4H3,(H,24,26)