N-methyl-N-[[3-(2-methylpropyl)-2-(oxolan-2-ylmethylsulfonyl)imidazol-4-yl]methyl]-2-phenoxy-ethanamine

Systemtic Name: N-methyl-N-[[3-(2-methylpropyl)-2-(oxolan-2-ylmethylsulfonyl)imidazol-4-yl]methyl]-2-phenoxy-ethanamine Openeye Name: N-[[3-isobutyl-2-(tetrahydrofuran-2-ylmethylsulfonyl)imidazol-4-yl]methyl]-N-methyl-2-phenoxy-ethanamine CAS Name: N-methyl-N-[[3-(2-methylpropyl)-2-(2-oxolanylmethylsulfonyl)-4-imidazolyl]methyl]-2-phenoxyethanamine IUPAC Name: N-methyl-N-[[3-(2-methylpropyl)-2-(oxolan-2-ylmethylsulfonyl)imidazol-4-yl]methyl]-2-phenoxyethanamine Traditional Name: [3-isobutyl-2-(tetrahydrofurfurylsulfonyl)imidazol-4-yl]methyl-methyl-(2-phenoxyethyl)amine Formula: C22H33N3O4S MolecularWeight: 435.58012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=CN=C1S(=O)(=O)CC2CCCO2)CN(C)CCOC3=CC=CC=C3

Isomeric SMILES

CC(C)CN1C(=CN=C1S(=O)(=O)CC2CCCO2)CN(C)CCOC3=CC=CC=C3

InChI

InChI=1S/C22H33N3O4S/c1-18(2)15-25-19(16-24(3)11-13-29-20-8-5-4-6-9-20)14-23-22(25)30(26,27)17-21-10-7-12-28-21/h4-6,8-9,14,18,21H,7,10-13,15-17H2,1-3H3