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

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-3-yl-ethyl]-2-(4-phenylphenyl)ethanamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-thienyl)ethyl]-2-(4-phenylphenyl)acetamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-thiophenyl)ethyl]-2-(4-phenylphenyl)acetamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-3-ylethyl]-2-(4-phenylphenyl)acetamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-thienyl)ethyl]-2-(4-phenylphenyl)acetamide Formula: C29H28N2OS MolecularWeight: 452.61042

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(CNC(=O)CC3=CC=C(C=C3)C4=CC=CC=C4)C5=CSC=C5

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(CNC(=O)CC3=CC=C(C=C3)C4=CC=CC=C4)C5=CSC=C5

InChI

InChI=1S/C29H28N2OS/c32-29(18-22-10-12-25(13-11-22)23-6-2-1-3-7-23)30-19-28(27-15-17-33-21-27)31-16-14-24-8-4-5-9-26(24)20-31/h1-13,15,17,21,28H,14,16,18-20H2,(H,30,32)