3-[3-(dimethylamino)propylsulfanyl]-1-morpholin-4-yl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile

Systemtic Name: 3-[3-(dimethylamino)propylsulfanyl]-1-morpholin-4-yl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Openeye Name: 3-[3-(dimethylamino)propylsulfanyl]-1-morpholino-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile CAS Name: 3-[3-(dimethylamino)propylthio]-1-(4-morpholinyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile IUPAC Name: 3-[3-(dimethylamino)propylsulfanyl]-1-morpholin-4-yl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Traditional Name: 3-[3-(dimethylamino)propylthio]-1-morpholino-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile Formula: C19H28N4OS MolecularWeight: 360.51682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCSC1=NC(=C2CCCCC2=C1C#N)N3CCOCC3

Isomeric SMILES

CN(C)CCCSC1=NC(=C2CCCCC2=C1C#N)N3CCOCC3

InChI

InChI=1S/C19H28N4OS/c1-22(2)8-5-13-25-19-17(14-20)15-6-3-4-7-16(15)18(21-19)23-9-11-24-12-10-23/h3-13H2,1-2H3