5-(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-6-yl)-3-[(1-pyridin-2-ylpiperidin-4-yl)methyl]-1,2,4-oxadiazole

Systemtic Name: 5-(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-6-yl)-3-[(1-pyridin-2-ylpiperidin-4-yl)methyl]-1,2,4-oxadiazole Openeye Name: 5-(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-6-yl)-3-[[1-(2-pyridyl)-4-piperidyl]methyl]-1,2,4-oxadiazole CAS Name: 5-(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-6-yl)-3-[[1-(2-pyridinyl)-4-piperidinyl]methyl]-1,2,4-oxadiazole IUPAC Name: 5-(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-6-yl)-3-[(1-pyridin-2-ylpiperidin-4-yl)methyl]-1,2,4-oxadiazole Traditional Name: 5-(2-mesyl-3,4-dihydro-1H-isoquinolin-6-yl)-3-[[1-(2-pyridyl)-4-piperidyl]methyl]-1,2,4-oxadiazole Formula: C23H27N5O3S MolecularWeight: 453.55718

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC2=C(C1)C=CC(=C2)C3=NC(=NO3)CC4CCN(CC4)C5=CC=CC=N5

Isomeric SMILES

CS(=O)(=O)N1CCC2=C(C1)C=CC(=C2)C3=NC(=NO3)CC4CCN(CC4)C5=CC=CC=N5

InChI

InChI=1S/C23H27N5O3S/c1-32(29,30)28-13-9-18-15-19(5-6-20(18)16-28)23-25-21(26-31-23)14-17-7-11-27(12-8-17)22-4-2-3-10-24-22/h2-6,10,15,17H,7-9,11-14,16H2,1H3