N-(3-ethylpent-1-yn-3-yl)-2-[4-(phenylcarbonyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(3-ethylpent-1-yn-3-yl)-2-[4-(phenylcarbonyl)piperazin-1-yl]ethanamide Openeye Name: 2-(4-benzoylpiperazin-1-yl)-N-(1,1-diethylprop-2-ynyl)acetamide CAS Name: 2-(4-benzoyl-1-piperazinyl)-N-(3-ethylpent-1-yn-3-yl)acetamide IUPAC Name: 2-(4-benzoylpiperazin-1-yl)-N-(3-ethylpent-1-yn-3-yl)acetamide Traditional Name: 2-(4-benzoylpiperazino)-N-(1,1-diethylprop-2-ynyl)acetamide Formula: C20H27N3O2 MolecularWeight: 341.44728

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=O)CN1CCN(CC1)C(=O)C2=CC=CC=C2

Isomeric SMILES

CCC(CC)(C#C)NC(=O)CN1CCN(CC1)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H27N3O2/c1-4-20(5-2,6-3)21-18(24)16-22-12-14-23(15-13-22)19(25)17-10-8-7-9-11-17/h1,7-11H,5-6,12-16H2,2-3H3,(H,21,24)