N-(2-chlorophenyl)-2-[4-[2-(3-ethylpent-1-yn-3-ylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]ethanamide

Systemtic Name: N-(2-chlorophenyl)-2-[4-[2-(3-ethylpent-1-yn-3-ylamino)-2-oxidanylidene-ethyl]piperazin-1-yl]ethanamide Openeye Name: N-(2-chlorophenyl)-2-[4-[2-(1,1-diethylprop-2-ynylamino)-2-oxo-ethyl]piperazin-1-yl]acetamide CAS Name: N-(2-chlorophenyl)-2-[4-[2-(3-ethylpent-1-yn-3-ylamino)-2-oxoethyl]-1-piperazinyl]acetamide IUPAC Name: N-(2-chlorophenyl)-2-[4-[2-(3-ethylpent-1-yn-3-ylamino)-2-oxoethyl]piperazin-1-yl]acetamide Traditional Name: N-(2-chlorophenyl)-2-[4-[2-(1,1-diethylprop-2-ynylamino)-2-keto-ethyl]piperazino]acetamide Formula: C21H29ClN4O2 MolecularWeight: 404.93356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=O)CN1CCN(CC1)CC(=O)NC2=CC=CC=C2Cl

Isomeric SMILES

CCC(CC)(C#C)NC(=O)CN1CCN(CC1)CC(=O)NC2=CC=CC=C2Cl

InChI

InChI=1S/C21H29ClN4O2/c1-4-21(5-2,6-3)24-20(28)16-26-13-11-25(12-14-26)15-19(27)23-18-10-8-7-9-17(18)22/h1,7-10H,5-6,11-16H2,2-3H3,(H,23,27)(H,24,28)