1-[[3-(2-methylpropyl)-2-methylsulfonyl-imidazol-4-yl]methyl]azepane

Systemtic Name: 1-[[3-(2-methylpropyl)-2-methylsulfonyl-imidazol-4-yl]methyl]azepane Openeye Name: 1-[(3-isobutyl-2-methylsulfonyl-imidazol-4-yl)methyl]azepane CAS Name: 1-[[3-(2-methylpropyl)-2-methylsulfonyl-4-imidazolyl]methyl]azepane IUPAC Name: 1-[[3-(2-methylpropyl)-2-methylsulfonylimidazol-4-yl]methyl]azepane Traditional Name: 1-[(3-isobutyl-2-mesyl-imidazol-4-yl)methyl]azepane Formula: C15H27N3O2S MolecularWeight: 313.45878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=CN=C1S(=O)(=O)C)CN2CCCCCC2

Isomeric SMILES

CC(C)CN1C(=CN=C1S(=O)(=O)C)CN2CCCCCC2

InChI

InChI=1S/C15H27N3O2S/c1-13(2)11-18-14(10-16-15(18)21(3,19)20)12-17-8-6-4-5-7-9-17/h10,13H,4-9,11-12H2,1-3H3