N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-[2-(pyrrolidin-1-ylmethyl)-4-thiophen-2-yl-phenoxy]ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-[2-(pyrrolidin-1-ylmethyl)-4-thiophen-2-yl-phenoxy]ethanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-[2-(pyrrolidin-1-ylmethyl)-4-(2-thienyl)phenoxy]acetamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-[2-(1-pyrrolidinylmethyl)-4-thiophen-2-ylphenoxy]acetamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-[2-(pyrrolidin-1-ylmethyl)-4-thiophen-2-ylphenoxy]acetamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-[2-(pyrrolidinomethyl)-4-(2-thienyl)phenoxy]acetamide Formula: C26H28N2O4S MolecularWeight: 464.57652

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=C(C=CC(=C2)C3=CC=CS3)OCC(=O)NCC4COC5=CC=CC=C5O4

Isomeric SMILES

C1CCN(C1)CC2=C(C=CC(=C2)C3=CC=CS3)OCC(=O)NCC4COC5=CC=CC=C5O4

InChI

InChI=1S/C26H28N2O4S/c29-26(27-15-21-17-30-23-6-1-2-7-24(23)32-21)18-31-22-10-9-19(25-8-5-13-33-25)14-20(22)16-28-11-3-4-12-28/h1-2,5-10,13-14,21H,3-4,11-12,15-18H2,(H,27,29)