1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(6-methyl-2-phenyl-quinazolin-4-yl)sulfanyl-ethanone

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(6-methyl-2-phenyl-quinazolin-4-yl)sulfanyl-ethanone Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(6-methyl-2-phenyl-quinazolin-4-yl)sulfanyl-ethanone CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(6-methyl-2-phenyl-4-quinazolinyl)thio]ethanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(6-methyl-2-phenylquinazolin-4-yl)sulfanylethanone Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(6-methyl-2-phenyl-quinazolin-4-yl)thio]ethanone Formula: C26H23N3OS MolecularWeight: 425.54532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N=C2SCC(=O)N3CCC4=CC=CC=C4C3)C5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N=C2SCC(=O)N3CCC4=CC=CC=C4C3)C5=CC=CC=C5

InChI

InChI=1S/C26H23N3OS/c1-18-11-12-23-22(15-18)26(28-25(27-23)20-8-3-2-4-9-20)31-17-24(30)29-14-13-19-7-5-6-10-21(19)16-29/h2-12,15H,13-14,16-17H2,1H3