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

Systemtic Name: N-(3-ethylpent-1-yn-3-yl)-2-[4-[(3-methylphenyl)methyl]piperazin-1-yl]ethanamide Openeye Name: N-(1,1-diethylprop-2-ynyl)-2-[4-(m-tolylmethyl)piperazin-1-yl]acetamide CAS Name: N-(3-ethylpent-1-yn-3-yl)-2-[4-[(3-methylphenyl)methyl]-1-piperazinyl]acetamide IUPAC Name: N-(3-ethylpent-1-yn-3-yl)-2-[4-[(3-methylphenyl)methyl]piperazin-1-yl]acetamide Traditional Name: N-(1,1-diethylprop-2-ynyl)-2-[4-(3-methylbenzyl)piperazino]acetamide Formula: C21H31N3O MolecularWeight: 341.49034

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=O)CN1CCN(CC1)CC2=CC=CC(=C2)C

Isomeric SMILES

CCC(CC)(C#C)NC(=O)CN1CCN(CC1)CC2=CC=CC(=C2)C

InChI

InChI=1S/C21H31N3O/c1-5-21(6-2,7-3)22-20(25)17-24-13-11-23(12-14-24)16-19-10-8-9-18(4)15-19/h1,8-10,15H,6-7,11-14,16-17H2,2-4H3,(H,22,25)