2-[[3-(2-methylpropyl)-2-(oxolan-2-ylmethylsulfonyl)imidazol-4-yl]methyl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[[3-(2-methylpropyl)-2-(oxolan-2-ylmethylsulfonyl)imidazol-4-yl]methyl]-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[[3-isobutyl-2-(tetrahydrofuran-2-ylmethylsulfonyl)imidazol-4-yl]methyl]-3,4-dihydro-1H-isoquinoline CAS Name: 2-[[3-(2-methylpropyl)-2-(2-oxolanylmethylsulfonyl)-4-imidazolyl]methyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[[3-(2-methylpropyl)-2-(oxolan-2-ylmethylsulfonyl)imidazol-4-yl]methyl]-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[[3-isobutyl-2-(tetrahydrofurfurylsulfonyl)imidazol-4-yl]methyl]-3,4-dihydro-1H-isoquinoline Formula: C22H31N3O3S MolecularWeight: 417.56484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=CN=C1S(=O)(=O)CC2CCCO2)CN3CCC4=CC=CC=C4C3

Isomeric SMILES

CC(C)CN1C(=CN=C1S(=O)(=O)CC2CCCO2)CN3CCC4=CC=CC=C4C3

InChI

InChI=1S/C22H31N3O3S/c1-17(2)13-25-20(15-24-10-9-18-6-3-4-7-19(18)14-24)12-23-22(25)29(26,27)16-21-8-5-11-28-21/h3-4,6-7,12,17,21H,5,8-11,13-16H2,1-2H3