2-(1-benzofuran-2-ylmethylamino)-N-[1-(1H-imidazol-5-yl)-3-oxidanyl-propan-2-yl]-3-(1H-indol-3-yl)-2-methyl-propanamide

Systemtic Name: 2-(1-benzofuran-2-ylmethylamino)-N-[1-(1H-imidazol-5-yl)-3-oxidanyl-propan-2-yl]-3-(1H-indol-3-yl)-2-methyl-propanamide Openeye Name: 2-(benzofuran-2-ylmethylamino)-N-[1-(hydroxymethyl)-2-(1H-imidazol-5-yl)ethyl]-3-(1H-indol-3-yl)-2-methyl-propanamide CAS Name: 2-(2-benzofuranylmethylamino)-N-[1-hydroxy-3-(1H-imidazol-5-yl)propan-2-yl]-3-(1H-indol-3-yl)-2-methylpropanamide IUPAC Name: 2-(1-benzofuran-2-ylmethylamino)-N-[1-hydroxy-3-(1H-imidazol-5-yl)propan-2-yl]-3-(1H-indol-3-yl)-2-methylpropanamide Traditional Name: 2-(benzofuran-2-ylmethylamino)-N-[2-hydroxy-1-(1H-imidazol-5-ylmethyl)ethyl]-3-(1H-indol-3-yl)-2-methyl-propionamide Formula: C27H29N5O3 MolecularWeight: 471.55086

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CNC2=CC=CC=C21)(C(=O)NC(CC3=CN=CN3)CO)NCC4=CC5=CC=CC=C5O4

Isomeric SMILES

CC(CC1=CNC2=CC=CC=C21)(C(=O)NC(CC3=CN=CN3)CO)NCC4=CC5=CC=CC=C5O4

InChI

InChI=1S/C27H29N5O3/c1-27(12-19-13-29-24-8-4-3-7-23(19)24,26(34)32-21(16-33)11-20-14-28-17-30-20)31-15-22-10-18-6-2-5-9-25(18)35-22/h2-10,13-14,17,21,29,31,33H,11-12,15-16H2,1H3,(H,28,30)(H,32,34)