4-[[4-[[2-(2-methylsulfonylethyl)-3,4-dihydro-1H-isoquinolin-3-yl]methyl]imidazol-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[[2-(2-methylsulfonylethyl)-3,4-dihydro-1H-isoquinolin-3-yl]methyl]imidazol-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-[[2-(2-methylsulfonylethyl)-3,4-dihydro-1H-isoquinolin-3-yl]methyl]imidazol-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[[2-(2-methylsulfonylethyl)-3,4-dihydro-1H-isoquinolin-3-yl]methyl]-1-imidazolyl]methyl]benzonitrile IUPAC Name: 4-[[4-[[2-(2-methylsulfonylethyl)-3,4-dihydro-1H-isoquinolin-3-yl]methyl]imidazol-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-[[2-(2-mesylethyl)-3,4-dihydro-1H-isoquinolin-3-yl]methyl]imidazol-1-yl]methyl]benzonitrile Formula: C24H26N4O2S MolecularWeight: 434.55384

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCN1CC2=CC=CC=C2CC1CC3=CN(C=N3)CC4=CC=C(C=C4)C#N

Isomeric SMILES

CS(=O)(=O)CCN1CC2=CC=CC=C2CC1CC3=CN(C=N3)CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C24H26N4O2S/c1-31(29,30)11-10-28-16-22-5-3-2-4-21(22)12-24(28)13-23-17-27(18-26-23)15-20-8-6-19(14-25)7-9-20/h2-9,17-18,24H,10-13,15-16H2,1H3