(2S)-1-[2-[(2,5-dimethylphenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]-2-phenoxy-propan-1-one

Systemtic Name: (2S)-1-[2-[(2,5-dimethylphenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]-2-phenoxy-propan-1-one Openeye Name: (2S)-1-[2-[(2,5-dimethylphenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]-2-phenoxy-propan-1-one CAS Name: (2S)-1-[2-[(2,5-dimethylphenyl)methylthio]-4,5-dihydroimidazol-1-yl]-2-phenoxy-1-propanone IUPAC Name: (2S)-1-[2-[(2,5-dimethylphenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]-2-phenoxypropan-1-one Traditional Name: (2S)-1-[2-[(2,5-dimethylbenzyl)thio]-2-imidazolin-1-yl]-2-phenoxy-propan-1-one Formula: C21H24N2O2S MolecularWeight: 368.49246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CSC2=NCCN2C(=O)C(C)OC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)CSC2=NCCN2C(=O)[C@H](C)OC3=CC=CC=C3

InChI

InChI=1S/C21H24N2O2S/c1-15-9-10-16(2)18(13-15)14-26-21-22-11-12-23(21)20(24)17(3)25-19-7-5-4-6-8-19/h4-10,13,17H,11-12,14H2,1-3H3/t17-/m0/s1