2-(1-benzofuran-2-ylmethylamino)-N-(2-cyclohexylethyl)-3-(1H-indol-3-yl)-2-methyl-propanamide

Systemtic Name: 2-(1-benzofuran-2-ylmethylamino)-N-(2-cyclohexylethyl)-3-(1H-indol-3-yl)-2-methyl-propanamide Openeye Name: 2-(benzofuran-2-ylmethylamino)-N-(2-cyclohexylethyl)-3-(1H-indol-3-yl)-2-methyl-propanamide CAS Name: 2-(2-benzofuranylmethylamino)-N-(2-cyclohexylethyl)-3-(1H-indol-3-yl)-2-methylpropanamide IUPAC Name: 2-(1-benzofuran-2-ylmethylamino)-N-(2-cyclohexylethyl)-3-(1H-indol-3-yl)-2-methylpropanamide Traditional Name: 2-(benzofuran-2-ylmethylamino)-N-(2-cyclohexylethyl)-3-(1H-indol-3-yl)-2-methyl-propionamide Formula: C29H35N3O2 MolecularWeight: 457.6071

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CNC2=CC=CC=C21)(C(=O)NCCC3CCCCC3)NCC4=CC5=CC=CC=C5O4

Isomeric SMILES

CC(CC1=CNC2=CC=CC=C21)(C(=O)NCCC3CCCCC3)NCC4=CC5=CC=CC=C5O4

InChI

InChI=1S/C29H35N3O2/c1-29(18-23-19-31-26-13-7-6-12-25(23)26,28(33)30-16-15-21-9-3-2-4-10-21)32-20-24-17-22-11-5-8-14-27(22)34-24/h5-8,11-14,17,19,21,31-32H,2-4,9-10,15-16,18,20H2,1H3,(H,30,33)