N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-3-yl-ethyl]-2-methyl-quinoline-8-sulfonamide

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-3-yl-ethyl]-2-methyl-quinoline-8-sulfonamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-thienyl)ethyl]-2-methyl-quinoline-8-sulfonamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-thiophenyl)ethyl]-2-methyl-8-quinolinesulfonamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-thiophen-3-ylethyl]-2-methylquinoline-8-sulfonamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-thienyl)ethyl]-2-methyl-quinoline-8-sulfonamide Formula: C25H25N3O2S2 MolecularWeight: 463.6149

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2S(=O)(=O)NCC(C3=CSC=C3)N4CCC5=CC=CC=C5C4)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2S(=O)(=O)NCC(C3=CSC=C3)N4CCC5=CC=CC=C5C4)C=C1

InChI

InChI=1S/C25H25N3O2S2/c1-18-9-10-20-7-4-8-24(25(20)27-18)32(29,30)26-15-23(22-12-14-31-17-22)28-13-11-19-5-2-3-6-21(19)16-28/h2-10,12,14,17,23,26H,11,13,15-16H2,1H3