2-(5-chloranylthiophen-2-yl)-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]quinoline-4-carboxamide

Systemtic Name: 2-(5-chloranylthiophen-2-yl)-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]quinoline-4-carboxamide Openeye Name: 2-(5-chloro-2-thienyl)-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]quinoline-4-carboxamide CAS Name: 2-(5-chloro-2-thiophenyl)-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-4-quinolinecarboxamide IUPAC Name: 2-(5-chlorothiophen-2-yl)-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]quinoline-4-carboxamide Traditional Name: 2-(5-chloro-2-thienyl)-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]cinchoninamide Formula: C26H24ClN3OS MolecularWeight: 462.00626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CCCNC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(S5)Cl

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CCCNC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(S5)Cl

InChI

InChI=1S/C26H24ClN3OS/c27-25-11-10-24(32-25)23-16-21(20-8-3-4-9-22(20)29-23)26(31)28-13-5-14-30-15-12-18-6-1-2-7-19(18)17-30/h1-4,6-11,16H,5,12-15,17H2,(H,28,31)