3-(1-benzofuran-2-ylmethylamino)-N-(pyridin-2-ylmethyl)-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 3-(1-benzofuran-2-ylmethylamino)-N-(pyridin-2-ylmethyl)-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 3-(benzofuran-2-ylmethylamino)-N-(2-pyridylmethyl)-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 3-(2-benzofuranylmethylamino)-N-(2-pyridinylmethyl)-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 3-(1-benzofuran-2-ylmethylamino)-N-(pyridin-2-ylmethyl)-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 3-(benzofuran-2-ylmethylamino)-N-(2-pyridylmethyl)-5-pyrrolidinosulfonyl-benzamide Formula: C26H26N4O4S MolecularWeight: 490.57404

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=CC(=C2)NCC3=CC4=CC=CC=C4O3)C(=O)NCC5=CC=CC=N5

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=CC(=C2)NCC3=CC4=CC=CC=C4O3)C(=O)NCC5=CC=CC=N5

InChI

InChI=1S/C26H26N4O4S/c31-26(29-17-21-8-3-4-10-27-21)20-13-22(16-24(15-20)35(32,33)30-11-5-6-12-30)28-18-23-14-19-7-1-2-9-25(19)34-23/h1-4,7-10,13-16,28H,5-6,11-12,17-18H2,(H,29,31)