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

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[[(4-methylphenyl)-thiophen-2-yl-methyl]amino]ethanamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[[p-tolyl(2-thienyl)methyl]amino]acetamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[[(4-methylphenyl)-thiophen-2-ylmethyl]amino]acetamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[[(4-methylphenyl)-thiophen-2-ylmethyl]amino]acetamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[[p-tolyl(2-thienyl)methyl]amino]acetamide Formula: C23H24N2O3S MolecularWeight: 408.51326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CS2)NCC(=O)NC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=CS2)NCC(=O)NC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C23H24N2O3S/c1-16-5-7-17(8-6-16)23(21-4-2-13-29-21)24-15-22(26)25-18-9-10-19-20(14-18)28-12-3-11-27-19/h2,4-10,13-14,23-24H,3,11-12,15H2,1H3,(H,25,26)