N-ethyl-N-[2-(2-methylphenyl)imidazo[2,1-a]isoquinolin-3-yl]-3-methylsulfanyl-propanamide

Systemtic Name: N-ethyl-N-[2-(2-methylphenyl)imidazo[2,1-a]isoquinolin-3-yl]-3-methylsulfanyl-propanamide Openeye Name: N-ethyl-3-methylsulfanyl-N-[2-(o-tolyl)imidazo[2,1-a]isoquinolin-3-yl]propanamide CAS Name: N-ethyl-N-[2-(2-methylphenyl)-3-imidazo[2,1-a]isoquinolinyl]-3-(methylthio)propanamide IUPAC Name: N-ethyl-N-[2-(2-methylphenyl)imidazo[2,1-a]isoquinolin-3-yl]-3-methylsulfanylpropanamide Traditional Name: N-ethyl-3-(methylthio)-N-[2-(o-tolyl)imidaz[2,1-a]isoquinolin-3-yl]propionamide Formula: C24H25N3OS MolecularWeight: 403.5398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=C(N=C2N1C=CC3=CC=CC=C32)C4=CC=CC=C4C)C(=O)CCSC

Isomeric SMILES

CCN(C1=C(N=C2N1C=CC3=CC=CC=C32)C4=CC=CC=C4C)C(=O)CCSC

InChI

InChI=1S/C24H25N3OS/c1-4-26(21(28)14-16-29-3)24-22(19-11-7-5-9-17(19)2)25-23-20-12-8-6-10-18(20)13-15-27(23)24/h5-13,15H,4,14,16H2,1-3H3