3-(phenoxymethyl)-N-(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)-1-benzofuran-2-carboxamide

Systemtic Name: 3-(phenoxymethyl)-N-(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)-1-benzofuran-2-carboxamide Openeye Name: 3-(phenoxymethyl)-N-[2-pyrrolidin-1-yl-2-(2-thienyl)ethyl]benzofuran-2-carboxamide CAS Name: 3-(phenoxymethyl)-N-[2-(1-pyrrolidinyl)-2-thiophen-2-ylethyl]-2-benzofurancarboxamide IUPAC Name: 3-(phenoxymethyl)-N-(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)-1-benzofuran-2-carboxamide Traditional Name: 3-(phenoxymethyl)-N-[2-pyrrolidino-2-(2-thienyl)ethyl]coumarilamide Formula: C26H26N2O3S MolecularWeight: 446.56124

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)C2=C(C3=CC=CC=C3O2)COC4=CC=CC=C4)C5=CC=CS5

Isomeric SMILES

C1CCN(C1)C(CNC(=O)C2=C(C3=CC=CC=C3O2)COC4=CC=CC=C4)C5=CC=CS5

InChI

InChI=1S/C26H26N2O3S/c29-26(27-17-22(24-13-8-16-32-24)28-14-6-7-15-28)25-21(18-30-19-9-2-1-3-10-19)20-11-4-5-12-23(20)31-25/h1-5,8-13,16,22H,6-7,14-15,17-18H2,(H,27,29)