N-[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]-N'-(2,2-dimethoxyethyl)ethanediamide

Systemtic Name: N-[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]-N'-(2,2-dimethoxyethyl)ethanediamide Openeye Name: N-[2-(azepan-1-yl)-2-(3-thienyl)ethyl]-N'-(2,2-dimethoxyethyl)oxamide CAS Name: N-[2-(1-azepanyl)-2-(3-thiophenyl)ethyl]-N'-(2,2-dimethoxyethyl)oxamide IUPAC Name: N-[2-(azepan-1-yl)-2-thiophen-3-ylethyl]-N'-(2,2-dimethoxyethyl)oxamide Traditional Name: N-[2-(azepan-1-yl)-2-(3-thienyl)ethyl]-N'-(2,2-dimethoxyethyl)oxamide Formula: C18H29N3O4S MolecularWeight: 383.50556

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Descriptors Computed from Structure

Canonical SMILES:

COC(CNC(=O)C(=O)NCC(C1=CSC=C1)N2CCCCCC2)OC

Isomeric SMILES

COC(CNC(=O)C(=O)NCC(C1=CSC=C1)N2CCCCCC2)OC

InChI

InChI=1S/C18H29N3O4S/c1-24-16(25-2)12-20-18(23)17(22)19-11-15(14-7-10-26-13-14)21-8-5-3-4-6-9-21/h7,10,13,15-16H,3-6,8-9,11-12H2,1-2H3,(H,19,22)(H,20,23)