1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[1-(2,4-dimethylphenyl)imidazol-2-yl]sulfanyl-propan-1-one

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[1-(2,4-dimethylphenyl)imidazol-2-yl]sulfanyl-propan-1-one Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[1-(2,4-dimethylphenyl)imidazol-2-yl]sulfanyl-propan-1-one CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[[1-(2,4-dimethylphenyl)-2-imidazolyl]thio]-1-propanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[1-(2,4-dimethylphenyl)imidazol-2-yl]sulfanylpropan-1-one Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[[1-(2,4-dimethylphenyl)imidazol-2-yl]thio]propan-1-one Formula: C23H25N3OS MolecularWeight: 391.5291

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C=CN=C2SC(C)C(=O)N3CCC4=CC=CC=C4C3)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C=CN=C2SC(C)C(=O)N3CCC4=CC=CC=C4C3)C

InChI

InChI=1S/C23H25N3OS/c1-16-8-9-21(17(2)14-16)26-13-11-24-23(26)28-18(3)22(27)25-12-10-19-6-4-5-7-20(19)15-25/h4-9,11,13-14,18H,10,12,15H2,1-3H3