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

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-[(5-methylfuran-2-yl)methyl]quinoline-4-carboxamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-[(5-methyl-2-furyl)methyl]quinoline-4-carboxamide CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-[(5-methyl-2-furanyl)methyl]-4-quinolinecarboxamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-[(5-methylfuran-2-yl)methyl]quinoline-4-carboxamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-[(5-methyl-2-furyl)methyl]cinchoninamide Formula: C25H23N3O2 MolecularWeight: 397.46902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CNC(=O)C2=CC(=NC3=CC=CC=C32)N4CCC5=CC=CC=C5C4

Isomeric SMILES

CC1=CC=C(O1)CNC(=O)C2=CC(=NC3=CC=CC=C32)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C25H23N3O2/c1-17-10-11-20(30-17)15-26-25(29)22-14-24(27-23-9-5-4-8-21(22)23)28-13-12-18-6-2-3-7-19(18)16-28/h2-11,14H,12-13,15-16H2,1H3,(H,26,29)