N'-[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]-N-prop-2-enyl-ethanediamide

Systemtic Name: N'-[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]-N-prop-2-enyl-ethanediamide Openeye Name: N-allyl-N'-[2-(azepan-1-yl)-2-(3-thienyl)ethyl]oxamide CAS Name: N'-[2-(1-azepanyl)-2-(3-thiophenyl)ethyl]-N-prop-2-enyloxamide IUPAC Name: N'-[2-(azepan-1-yl)-2-thiophen-3-ylethyl]-N-prop-2-enyloxamide Traditional Name: N-allyl-N'-[2-(azepan-1-yl)-2-(3-thienyl)ethyl]oxamide Formula: C17H25N3O2S MolecularWeight: 335.4643

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C(=O)NCC(C1=CSC=C1)N2CCCCCC2

Isomeric SMILES

C=CCNC(=O)C(=O)NCC(C1=CSC=C1)N2CCCCCC2

InChI

InChI=1S/C17H25N3O2S/c1-2-8-18-16(21)17(22)19-12-15(14-7-11-23-13-14)20-9-5-3-4-6-10-20/h2,7,11,13,15H,1,3-6,8-10,12H2,(H,18,21)(H,19,22)