1-(3-aminophenyl)-4-(2-morpholin-4-ylethyl)-2,4-dihydro-1H-isoquinoline-3-thione

Systemtic Name: 1-(3-aminophenyl)-4-(2-morpholin-4-ylethyl)-2,4-dihydro-1H-isoquinoline-3-thione Openeye Name: 1-(3-aminophenyl)-4-(2-morpholinoethyl)-2,4-dihydro-1H-isoquinoline-3-thione CAS Name: 1-(3-aminophenyl)-4-[2-(4-morpholinyl)ethyl]-2,4-dihydro-1H-isoquinoline-3-thione IUPAC Name: 1-(3-aminophenyl)-4-(2-morpholin-4-ylethyl)-2,4-dihydro-1H-isoquinoline-3-thione Traditional Name: 1-(3-aminophenyl)-4-(2-morpholinoethyl)-2,4-dihydro-1H-isoquinoline-3-thione Formula: C21H25N3OS MolecularWeight: 367.5077

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCC2C3=CC=CC=C3C(NC2=S)C4=CC(=CC=C4)N

Isomeric SMILES

C1COCCN1CCC2C3=CC=CC=C3C(NC2=S)C4=CC(=CC=C4)N

InChI

InChI=1S/C21H25N3OS/c22-16-5-3-4-15(14-16)20-18-7-2-1-6-17(18)19(21(26)23-20)8-9-24-10-12-25-13-11-24/h1-7,14,19-20H,8-13,22H2,(H,23,26)