2-cyclohexyl-2-[3-(2-methylpropyl)-4-(quinolin-2-ylmethoxy)phenyl]-N-methylsulfonyl-ethanamide

Systemtic Name: 2-cyclohexyl-2-[3-(2-methylpropyl)-4-(quinolin-2-ylmethoxy)phenyl]-N-methylsulfonyl-ethanamide Openeye Name: 2-cyclohexyl-2-[3-isobutyl-4-(2-quinolylmethoxy)phenyl]-N-methylsulfonyl-acetamide CAS Name: 2-cyclohexyl-2-[3-(2-methylpropyl)-4-(2-quinolinylmethoxy)phenyl]-N-methylsulfonylacetamide IUPAC Name: 2-cyclohexyl-2-[3-(2-methylpropyl)-4-(quinolin-2-ylmethoxy)phenyl]-N-methylsulfonylacetamide Traditional Name: 2-cyclohexyl-2-[3-isobutyl-4-(2-quinolylmethoxy)phenyl]-N-mesyl-acetamide Formula: C29H36N2O4S MolecularWeight: 508.67214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C=CC(=C1)C(C2CCCCC2)C(=O)NS(=O)(=O)C)OCC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CC(C)CC1=C(C=CC(=C1)C(C2CCCCC2)C(=O)NS(=O)(=O)C)OCC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C29H36N2O4S/c1-20(2)17-24-18-23(28(22-10-5-4-6-11-22)29(32)31-36(3,33)34)14-16-27(24)35-19-25-15-13-21-9-7-8-12-26(21)30-25/h7-9,12-16,18,20,22,28H,4-6,10-11,17,19H2,1-3H3,(H,31,32)