2-[[1-(1H-imidazol-5-ylsulfonyl)piperidin-3-yl]methyl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[[1-(1H-imidazol-5-ylsulfonyl)piperidin-3-yl]methyl]-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[[1-(1H-imidazol-5-ylsulfonyl)-3-piperidyl]methyl]-3,4-dihydro-1H-isoquinoline CAS Name: 2-[[1-(1H-imidazol-5-ylsulfonyl)-3-piperidinyl]methyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[[1-(1H-imidazol-5-ylsulfonyl)piperidin-3-yl]methyl]-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[[1-(1H-imidazol-5-ylsulfonyl)-3-piperidyl]methyl]-3,4-dihydro-1H-isoquinoline Formula: C18H24N4O2S MolecularWeight: 360.47376

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CN=CN2)CN3CCC4=CC=CC=C4C3

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CN=CN2)CN3CCC4=CC=CC=C4C3

InChI

InChI=1S/C18H24N4O2S/c23-25(24,18-10-19-14-20-18)22-8-3-4-15(12-22)11-21-9-7-16-5-1-2-6-17(16)13-21/h1-2,5-6,10,14-15H,3-4,7-9,11-13H2,(H,19,20)