N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-3-yl-ethyl]-2-ethoxy-naphthalene-1-carboxamide

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-3-yl-ethyl]-2-ethoxy-naphthalene-1-carboxamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-thienyl)ethyl]-2-ethoxy-naphthalene-1-carboxamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-thiophenyl)ethyl]-2-ethoxy-1-naphthalenecarboxamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-3-ylethyl]-2-ethoxynaphthalene-1-carboxamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-thienyl)ethyl]-2-ethoxy-1-naphthamide Formula: C28H28N2O2S MolecularWeight: 456.59912

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C2=CC=CC=C2C=C1)C(=O)NCC(C3=CSC=C3)N4CCC5=CC=CC=C5C4

Isomeric SMILES

CCOC1=C(C2=CC=CC=C2C=C1)C(=O)NCC(C3=CSC=C3)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C28H28N2O2S/c1-2-32-26-12-11-21-8-5-6-10-24(21)27(26)28(31)29-17-25(23-14-16-33-19-23)30-15-13-20-7-3-4-9-22(20)18-30/h3-12,14,16,19,25H,2,13,15,17-18H2,1H3,(H,29,31)