2-[[2-methylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[[2-methylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[[2-methylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]-3,4-dihydro-1H-isoquinoline CAS Name: 2-[[2-methylsulfonyl-3-(3-phenylpropyl)-4-imidazolyl]methyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[[2-methylsulfonyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[[2-mesyl-3-(3-phenylpropyl)imidazol-4-yl]methyl]-3,4-dihydro-1H-isoquinoline Formula: C23H27N3O2S MolecularWeight: 409.54438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NC=C(N1CCCC2=CC=CC=C2)CN3CCC4=CC=CC=C4C3

Isomeric SMILES

CS(=O)(=O)C1=NC=C(N1CCCC2=CC=CC=C2)CN3CCC4=CC=CC=C4C3

InChI

InChI=1S/C23H27N3O2S/c1-29(27,28)23-24-16-22(26(23)14-7-10-19-8-3-2-4-9-19)18-25-15-13-20-11-5-6-12-21(20)17-25/h2-6,8-9,11-12,16H,7,10,13-15,17-18H2,1H3