N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]ethanamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]ethanamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]acetamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[methyl-[[4-(methylthio)phenyl]methyl]amino]acetamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]acetamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[methyl-[4-(methylthio)benzyl]amino]acetamide Formula: C20H24N2O3S MolecularWeight: 372.48116

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N2O3S/c1-22(13-15-4-7-17(26-2)8-5-15)14-20(23)21-16-6-9-18-19(12-16)25-11-3-10-24-18/h4-9,12H,3,10-11,13-14H2,1-2H3,(H,21,23)