N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-methylphenyl)sulfanyl-ethanamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-methylphenyl)sulfanyl-ethanamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(o-tolylsulfanyl)acetamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[(2-methylphenyl)thio]acetamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(2-methylphenyl)sulfanylacetamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(o-tolylthio)acetamide Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(=O)NC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC1=CC=CC=C1SCC(=O)NC2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C18H19NO3S/c1-13-5-2-3-6-17(13)23-12-18(20)19-14-7-8-15-16(11-14)22-10-4-9-21-15/h2-3,5-8,11H,4,9-10,12H2,1H3,(H,19,20)