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

Systemtic Name: 2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-N-(3-ethylpent-1-yn-3-yl)ethanamide Openeye Name: 2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-N-(1,1-diethylprop-2-ynyl)acetamide CAS Name: 2-[4-(1-azepanylsulfonyl)-1-piperazinyl]-N-(3-ethylpent-1-yn-3-yl)acetamide IUPAC Name: 2-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-N-(3-ethylpent-1-yn-3-yl)acetamide Traditional Name: 2-[4-(azepan-1-ylsulfonyl)piperazino]-N-(1,1-diethylprop-2-ynyl)acetamide Formula: C19H34N4O3S MolecularWeight: 398.56326

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=O)CN1CCN(CC1)S(=O)(=O)N2CCCCCC2

Isomeric SMILES

CCC(CC)(C#C)NC(=O)CN1CCN(CC1)S(=O)(=O)N2CCCCCC2

InChI

InChI=1S/C19H34N4O3S/c1-4-19(5-2,6-3)20-18(24)17-21-13-15-23(16-14-21)27(25,26)22-11-9-7-8-10-12-22/h1H,5-17H2,2-3H3,(H,20,24)