1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(2-propylquinazolin-4-yl)sulfanyl-ethanone

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(2-propylquinazolin-4-yl)sulfanyl-ethanone Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(2-propylquinazolin-4-yl)sulfanyl-ethanone CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(2-propyl-4-quinazolinyl)thio]ethanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(2-propylquinazolin-4-yl)sulfanylethanone Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(2-propylquinazolin-4-yl)thio]ethanone Formula: C22H23N3OS MolecularWeight: 377.50252

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=CC=CC=C2C(=N1)SCC(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CCCC1=NC2=CC=CC=C2C(=N1)SCC(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C22H23N3OS/c1-2-7-20-23-19-11-6-5-10-18(19)22(24-20)27-15-21(26)25-13-12-16-8-3-4-9-17(16)14-25/h3-6,8-11H,2,7,12-15H2,1H3