N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-3-yl-ethyl]-2-(2,3,5-trimethylphenoxy)ethanamide

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-3-yl-ethyl]-2-(2,3,5-trimethylphenoxy)ethanamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-thienyl)ethyl]-2-(2,3,5-trimethylphenoxy)acetamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-thiophenyl)ethyl]-2-(2,3,5-trimethylphenoxy)acetamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-3-ylethyl]-2-(2,3,5-trimethylphenoxy)acetamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-thienyl)ethyl]-2-(2,3,5-trimethylphenoxy)acetamide Formula: C26H30N2O2S MolecularWeight: 434.5936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OCC(=O)NCC(C2=CSC=C2)N3CCC4=CC=CC=C4C3)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OCC(=O)NCC(C2=CSC=C2)N3CCC4=CC=CC=C4C3)C)C

InChI

InChI=1S/C26H30N2O2S/c1-18-12-19(2)20(3)25(13-18)30-16-26(29)27-14-24(23-9-11-31-17-23)28-10-8-21-6-4-5-7-22(21)15-28/h4-7,9,11-13,17,24H,8,10,14-16H2,1-3H3,(H,27,29)