2-(1-benzofuran-2-ylmethylamino)-N-(3-imidazol-1-ylpropyl)-3-(1H-indol-3-yl)propanamide

Systemtic Name: 2-(1-benzofuran-2-ylmethylamino)-N-(3-imidazol-1-ylpropyl)-3-(1H-indol-3-yl)propanamide Openeye Name: 2-(benzofuran-2-ylmethylamino)-N-(3-imidazol-1-ylpropyl)-3-(1H-indol-3-yl)propanamide CAS Name: 2-(2-benzofuranylmethylamino)-N-[3-(1-imidazolyl)propyl]-3-(1H-indol-3-yl)propanamide IUPAC Name: 2-(1-benzofuran-2-ylmethylamino)-N-(3-imidazol-1-ylpropyl)-3-(1H-indol-3-yl)propanamide Traditional Name: 2-(benzofuran-2-ylmethylamino)-N-(3-imidazol-1-ylpropyl)-3-(1H-indol-3-yl)propionamide Formula: C26H27N5O2 MolecularWeight: 441.52488

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(O2)CNC(CC3=CNC4=CC=CC=C43)C(=O)NCCCN5C=CN=C5

Isomeric SMILES

C1=CC=C2C(=C1)C=C(O2)CNC(CC3=CNC4=CC=CC=C43)C(=O)NCCCN5C=CN=C5

InChI

InChI=1S/C26H27N5O2/c32-26(28-10-5-12-31-13-11-27-18-31)24(15-20-16-29-23-8-3-2-7-22(20)23)30-17-21-14-19-6-1-4-9-25(19)33-21/h1-4,6-9,11,13-14,16,18,24,29-30H,5,10,12,15,17H2,(H,28,32)