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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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